Search is not available for this dataset
smiles stringlengths 12 61 | mz listlengths 16 322 | intensity listlengths 16 322 |
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COCC1CC1CC1(OCC(=O)O)CC2CC1CC2F | [
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COC(CN1CCC(N)CC1(C)C)C1CCOC1 | [
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CCC1CCC1(NC1CCC1N(C)C)C(=O)O | [
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CC(C)CC(C)CC(NN)c1snnc1C1CC1 | [
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CNC(=O)C1(C)CCN(C(=O)NC2CCC2)C1 | [
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CC(NCc1c(O)ccc2ccccc12)c1ccsc1 | [
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