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stringlengths 23
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CC(C)(C)OC(=O)NCCC1=CC=CN=C1 CC(C)(C)OC(=O)NCCc1cccnc1 Molport-000-001-450
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CC(C)(C)OC(=O)NC1CCC(=O)CC1 CC(C)(C)OC(=O)NC1CCC(=O)CC1 Molport-000-001-451
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CC(C)(C)OC(=O)NCC1CN(CC1O)C(=O)OC(C)(C)C CC(C)(C)OC(=O)NCC1CN(CC1O)C(=O)OC(C)(C)C Molport-000-001-452
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CC(C)(C)OC(=O)NCCCN CC(C)(C)OC(=O)NCCCN Molport-000-001-453
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CC(C)(C)OC(=O)NC1CCC(N)CC1 CC(C)(C)OC(=O)NC1CCC(N)CC1 Molport-000-001-454
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CC(C)(C)OC(=O)NCC(C)(C)CN CC(C)(C)OC(=O)NCC(C)(C)CN Molport-000-001-455
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CC(C)(C)OC(=O)N1CCC(COS(C)(=O)=O)C1 CC(C)(C)OC(=O)N1CCC(COS(C)(=O)=O)C1 Molport-000-001-456
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NNC(=O)C1CCN(CC2=CC=CC=C2)C1 NNC(=O)C1CCN(Cc2ccccc2)C1 Molport-000-001-457
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CC(C)(C)OC(=O)N[C@@H](CC(O)=O)CC1=CC=CC=C1 CC(C)(C)OC(=O)N[C@@H](CC(O)=O)Cc1ccccc1 Molport-000-001-458
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CC(O)=O.CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(N)=N CC(O)=O.CC(C)(C)OC(=O)NCc1ccc(cc1)C(N)=N Molport-000-001-459
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CC(C)(C)OC(=O)NCC1CCCNC1 CC(C)(C)OC(=O)NCC1CCCNC1 Molport-000-001-460
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CC(C)(C)OC(=O)NCCC1CCNCC1 CC(C)(C)OC(=O)NCCC1CCNCC1 Molport-000-001-461
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CC(C)(C)OC(=O)NCC1CCNCC1 CC(C)(C)OC(=O)NCC1CCNCC1 Molport-000-001-462
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CC(C)(C)OC(=O)NCC1=CC=NC=C1 CC(C)(C)OC(=O)NCc1ccncc1 Molport-000-001-463
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CC(C)(C)OC(=O)NCC1CCCCN1 CC(C)(C)OC(=O)NCC1CCCCN1 Molport-000-001-464
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CC(C)(C)OC(=O)C[C@@H](CO)NC(=O)OC(C)(C)C CC(C)(C)OC(=O)C[C@@H](CO)NC(=O)OC(C)(C)C Molport-000-001-465
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C[C@@H](NC(=O)OC(C)(C)C)C(O)=O C[C@@H](NC(=O)OC(C)(C)C)C(O)=O Molport-000-001-466
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CC(C)(C)OC(=O)N1CCC(CC1)OCC(O)=O CC(C)(C)OC(=O)N1CCC(CC1)OCC(O)=O Molport-000-001-467
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CC(C)(C)OC(=O)N1CCN(C(C1)C(O)=O)C(=O)OCC1=CC=CC=C1 CC(C)(C)OC(=O)N1CCN(C(C1)C(O)=O)C(=O)OCc1ccccc1 Molport-000-001-468
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CCC(NC(=O)OC(C)(C)C)C(O)=O CCC(NC(=O)OC(C)(C)C)C(O)=O Molport-000-001-469
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CC(CC(O)=O)NC(=O)OC(C)(C)C CC(CC(O)=O)NC(=O)OC(C)(C)C Molport-000-001-470
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CC(C)(C)OC(=O)N1CCCC(=O)CC1 CC(C)(C)OC(=O)N1CCCC(=O)CC1 Molport-000-001-471
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CC(C)(C)OC(=O)N[C@H](C(O)=O)C1=CC=CC2=CC=CC=C12 CC(C)(C)OC(=O)N[C@H](C(O)=O)c1cccc2ccccc12 Molport-000-001-472
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COC(=O)[C@@H]1CCC(=O)N1C(=O)OC(C)(C)C COC(=O)[C@@H]1CCC(=O)N1C(=O)OC(C)(C)C Molport-000-001-473
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CC1CN(CCC1C(O)=O)C(=O)OC(C)(C)C CC1CN(CCC1C(O)=O)C(=O)OC(C)(C)C Molport-000-001-474
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CC(C)(C)OC(=O)N1CCOCC1C(O)=O CC(C)(C)OC(=O)N1CCOCC1C(O)=O Molport-000-001-475
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CC(C)(C)OC(=O)N1C2CCC1CC(=O)C2 CC(C)(C)OC(=O)N1C2CCC1CC(=O)C2 Molport-000-001-476
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CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(O)=O CC(C)(C)OC(=O)NCc1ccc(cc1)C(O)=O Molport-000-001-477
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CC(C)(C)OC(=O)N1CCNC(C1)C(O)=O CC(C)(C)OC(=O)N1CCNC(C1)C(O)=O Molport-000-001-478
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CC(C)(C)OC(=O)N1CCN[C@H](C1)C(O)=O CC(C)(C)OC(=O)N1CCN[C@H](C1)C(O)=O Molport-000-001-479
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CC(C)(C)OC(=O)N1CCN[C@@H](C1)C(O)=O CC(C)(C)OC(=O)N1CCN[C@@H](C1)C(O)=O Molport-000-001-480
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CC(C)(C)OC(=O)N1CCNC(=O)C1 CC(C)(C)OC(=O)N1CCNC(=O)C1 Molport-000-001-481
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CC(C)(C)OC(=O)N1CCC(CC(O)=O)CC1 CC(C)(C)OC(=O)N1CCC(CC(O)=O)CC1 Molport-000-001-482
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CC(C)(C)OC(=O)N1CCCC(CCC(O)=O)C1 CC(C)(C)OC(=O)N1CCCC(CCC(O)=O)C1 Molport-000-001-483
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CC(C)(C)OC(=O)N1CCC(CCC(O)=O)CC1 CC(C)(C)OC(=O)N1CCC(CCC(O)=O)CC1 Molport-000-001-484
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CC(C)(C)OC(=O)N1CCCC(=O)C1 CC(C)(C)OC(=O)N1CCCC(=O)C1 Molport-000-001-485
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CC(C)(C)OC(=O)N1CCC(CC(O)=O)C1 CC(C)(C)OC(=O)N1CCC(CC(O)=O)C1 Molport-000-001-486
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CC(C)(C)OC(=O)N1CCC(=O)C1 CC(C)(C)OC(=O)N1CCC(=O)C1 Molport-000-001-487
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CC(C)(C)OC(=O)N1C=C(CCN)C2=CC=CC=C12 CC(C)(C)OC(=O)n1cc(CCN)c2ccccc12 Molport-000-001-488
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BrC1=CC=C2CCCC(=O)NC2=C1 Brc1ccc2CCCC(=O)Nc2c1 Molport-000-001-489
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OCCCCCCCCCCCCBr OCCCCCCCCCCCCBr Molport-000-001-490
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OCCCCCCCCCCCCCCCCBr OCCCCCCCCCCCCCCCCBr Molport-000-001-492
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OCCCCCCCCCBr OCCCCCCCCCBr Molport-000-001-493
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OCCCCCCCCCCCCCCBr OCCCCCCCCCCCCCCBr Molport-000-001-494
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BrC1=CC=C(C=C1)C1=C(C=CC=C1)C#N Brc1ccc(cc1)-c1ccccc1C#N Molport-000-001-495
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OC1=NC=C(Br)C=N1 Oc1ncc(Br)cn1 Molport-000-001-499
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BrC1=CC=C2CC(=O)CCC2=C1 Brc1ccc2CC(=O)CCc2c1 Molport-000-001-500
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BrC1=CC=C(C=C1)C1=CC(=CC=C1)C#N Brc1ccc(cc1)-c1cccc(c1)C#N Molport-000-001-501
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OCCOC1=CC(Br)=CN=C1 OCCOc1cncc(Br)c1 Molport-000-001-502
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COC1=CC(OCCO)=CC=C1Br COc1cc(OCCO)ccc1Br Molport-000-001-503
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CC1=NNC=C1Br Cc1n[nH]cc1Br Molport-000-001-504
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BrCC(=O)NC1=CC=CC=C1C(=O)C1=CC=CC=C1 BrCC(=O)Nc1ccccc1C(=O)c1ccccc1 Molport-000-001-505
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BrC1=CC=C2OC=CC2=C1 Brc1ccc2occc2c1 Molport-000-001-506
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CSC1=NC=CC(CBr)=N1 CSc1nccc(CBr)n1 Molport-000-001-508
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OC(=O)C1=CC=C(CBr)C(=C1)[N+]([O-])=O OC(=O)c1ccc(CBr)c(c1)[N+]([O-])=O Molport-000-001-509
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BrCC1=CC=C(C=C1)C1=CC=CC=C1C#N BrCc1ccc(cc1)-c1ccccc1C#N Molport-000-001-510
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OC(=O)C1=NC(CBr)=CC=C1 OC(=O)c1cccc(CBr)n1 Molport-000-001-511
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BrC[C@@H]1CCC(=O)N1 BrC[C@@H]1CCC(=O)N1 Molport-000-001-512
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OC(=O)C1=CC(=CC=C1)C1=CC=C(Br)C=C1 OC(=O)c1cccc(c1)-c1ccc(Br)cc1 Molport-000-001-513
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OCC1CN(C(=O)O1)C1=CC=C(Br)C=C1 OCC1CN(C(=O)O1)c1ccc(Br)cc1 Molport-000-001-514
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CC(C)(C)OC(=O)[C@H](O)[C@H](N)C1=CC=CC=C1 CC(C)(C)OC(=O)[C@H](O)[C@H](N)c1ccccc1 Molport-000-001-515
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CC(C)(C)OC(=O)C1CCN(CC1)C(=O)OCC1=CC=CC=C1 CC(C)(C)OC(=O)C1CCN(CC1)C(=O)OCc1ccccc1 Molport-000-001-516
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CC(C)(C)C1=CC=C(CC(O)=O)C=C1 CC(C)(C)c1ccc(CC(O)=O)cc1 Molport-000-001-522
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CC(=O)OCCC#C CC(=O)OCCC#C Molport-000-001-523
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OC(=O)C1CCC(Br)C1 OC(=O)C1CCC(Br)C1 Molport-000-001-524
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CC(C)(C)OC(=O)N[C@@H]1COC(=O)C1 CC(C)(C)OC(=O)N[C@@H]1COC(=O)C1 Molport-000-001-525
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CC(C)(C)OC(=O)NC(C(O)=O)C1=CC=C(O)C=C1 CC(C)(C)OC(=O)NC(C(O)=O)c1ccc(O)cc1 Molport-000-001-526
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N#CCC1CN(CC2=CC=CC=C2)CCO1 N#CCC1CN(Cc2ccccc2)CCO1 Molport-000-001-527
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Br.CC1=CC=CC(CCBr)=N1 Br.Cc1cccc(CCBr)n1 Molport-000-001-528
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Cl.BrC1=CC(=CC=C1)N1CCNCC1=O Cl.Brc1cccc(c1)N1CCNCC1=O Molport-000-001-529
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C[C@@H]1CN(CC2=CC=CC=C2)C(=O)CN1 C[C@@H]1CN(Cc2ccccc2)C(=O)CN1 Molport-000-001-530
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CC(C)(C)OC(=O)NC1CCCNC1 CC(C)(C)OC(=O)NC1CCCNC1 Molport-000-001-531
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CC(C)(C)OC(=O)N1CCC(O)CC1 CC(C)(C)OC(=O)N1CCC(O)CC1 Molport-000-001-532
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CC(C)(C)OC(=O)NCCC(C)(C)C(O)=O CC(C)(C)OC(=O)NCCC(C)(C)C(O)=O Molport-000-001-533
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CC(C)(C)OC(=O)N1N=CC2=CC(=CC=C12)C(O)=O CC(C)(C)OC(=O)n1ncc2cc(ccc12)C(O)=O Molport-000-001-534
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BrCC1=CC=CC=C1OCC1=CC=CC=C1 BrCc1ccccc1OCc1ccccc1 Molport-000-001-535
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ICOCI ICOCI Molport-000-001-536
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CC(C)(C)OC(=O)NCCC1CCCCN1 CC(C)(C)OC(=O)NCCC1CCCCN1 Molport-000-001-537
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OC(=O)C1COCCN1CC1=CC=CC=C1 OC(=O)C1COCCN1Cc1ccccc1 Molport-000-001-538
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O=C(OCC1=CC=CC=C1)C1COCCN1CC1=CC=CC=C1 O=C(OCc1ccccc1)C1COCCN1Cc1ccccc1 Molport-000-001-539
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CC(C)(C)OC(=O)N1CCOC[C@H]1C(O)=O CC(C)(C)OC(=O)N1CCOC[C@H]1C(O)=O Molport-000-001-540
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OC(=O)[C@@H]1COCCN1CC1=CC=CC=C1 OC(=O)[C@@H]1COCCN1Cc1ccccc1 Molport-000-001-541
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OC(=O)[C@H]1COCCN1CC1=CC=CC=C1 OC(=O)[C@H]1COCCN1Cc1ccccc1 Molport-000-001-542
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CC(C)(C)OC(=O)N1CCOC[C@@H]1C(O)=O CC(C)(C)OC(=O)N1CCOC[C@@H]1C(O)=O Molport-000-001-543
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BrC[C@H]1CCC(=O)N1 BrC[C@H]1CCC(=O)N1 Molport-000-001-545
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CC(C)(C)OC(=O)N1CCCCC1CC(O)=O CC(C)(C)OC(=O)N1CCCCC1CC(O)=O Molport-000-001-546
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CC(C)(C)OC(=O)N[C@H]1CC[C@H](O)CC1 CC(C)(C)OC(=O)N[C@H]1CC[C@H](O)CC1 Molport-000-001-547
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CCOC(=O)CN1C(C)=CN=C(Br)C1=O CCOC(=O)Cn1c(C)cnc(Br)c1=O Molport-000-001-548
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ClC(=O)CC1=CC=C(Br)C=C1 ClC(=O)Cc1ccc(Br)cc1 Molport-000-001-549
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CC(C)(C)OC(=O)N1CCC(CC1)(C(O)=O)C1=CC=CC=C1 CC(C)(C)OC(=O)N1CCC(CC1)(C(O)=O)c1ccccc1 Molport-000-001-550
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O=C1NC2=CC=CC=C2S1 O=c1[nH]c2ccccc2s1 Molport-000-001-551
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O=C1COC2=CC=CC=C2N1 O=C1COc2ccccc2N1 Molport-000-001-552
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O=C1CNCCN1CC1=CC=CC=C1 O=C1CNCCN1Cc1ccccc1 Molport-000-001-553
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BrCC1CN(CC2=CC=CC=C2)CCO1 BrCC1CN(Cc2ccccc2)CCO1 Molport-000-001-555
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OC(=O)C1CCN(CC2=CC=CC=C2)C1 OC(=O)C1CCN(Cc2ccccc2)C1 Molport-000-001-556
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CC(C)(C)OC(=O)CCCl CC(C)(C)OC(=O)CCCl Molport-000-001-557
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OCC1CCN(CC2=CC=CC=C2)C1 OCC1CCN(Cc2ccccc2)C1 Molport-000-001-558
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CC(C)(C)OC(=O)N1CCOC2(CCCCC2)C1 CC(C)(C)OC(=O)N1CCOC2(CCCCC2)C1 Molport-000-001-561
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CC(C)(C)OC(=O)N1CCOC2(CCCC2)C1 CC(C)(C)OC(=O)N1CCOC2(CCCC2)C1 Molport-000-001-562
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CC(C)(C)OC(=O)N1CCC(CO)C1 CC(C)(C)OC(=O)N1CCC(CO)C1 Molport-000-001-563
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