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Clopidogrel
SpectraBase Compound ID 1691fJI1PSG
InChI InChI=1S/C16H16ClNO2S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14/h2-5,7,9,15H,6,8,10H2,1H3/t15-/m0/s1
InChIKey GKTWGGQPFAXNFI-HNNXBMFYSA-N
Mol Weight 321.82 g/mol
Molecular Formula C16H16ClNO2S
Exact Mass 321.059028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EgtxfKmsq1r
Name (2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetic acid methyl ester
Alternate Name(s) Clopidogrel Clopidogrel sulfate Methyl (2S)-(2-chlorophenyl)(6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)ethanoate Methyl (2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetate Methyl (2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanoate
CAS Registry Number 113665-84-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16ClNO2S
InChI InChI=1S/C16H16ClNO2S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14/h2-5,7,9,15H,6,8,10H2,1H3/t15-/m0/s1
InChIKey GKTWGGQPFAXNFI-HNNXBMFYSA-N
Molecular Weight 321.822 g/mol
SMILES C1c2c(CN([C@@](c3ccccc3Cl)(C(=O)OC)[H])C1)ccs2
SPLASH splash10-03di-4940000000-05dee4489b3bc73ee0ed
Wiley ID 1508128