Search is not available for this dataset
smiles stringlengths 12 61 | mz listlengths 16 322 | intensity listlengths 16 322 |
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FC1CCC1Nc1ccc(OC(F)(F)F)cc1 | [
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CC(NC1CCC2(CC2)C1)c1ccc(NC(N)=O)cc1 | [
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CCN1CCN(C(=O)CCC(C)OC)CC1 | [
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CC(C)c1ccc(OC(=O)c2cc3ccccc3nc2O)cc1 | [
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COC1CN(C(C)C2CC3CCC2O3)CC1C(=O)O | [
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Cc1ncc(CNC(c2ccccc2)C(O)c2ccccc2)n1C | [
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