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(5S,6S)-6-(4-Chloro-butyl)-5-hydroxy-4-phenylsulfanyl-5,6-dihydro-1H-pyridin-2-one

View entire compound with spectra: 1 MS (GC)

(5S,6S)-6-(4-Chloro-butyl)-5-hydroxy-4-phenylsulfanyl-5,6-dihydro-1H-pyridin-2-one
SpectraBase Compound ID 4ICm9Zs2oiw
InChI InChI=1S/C15H18ClNO2S/c16-9-5-4-8-12-15(19)13(10-14(18)17-12)20-11-6-2-1-3-7-11/h1-3,6-7,10,12,15,19H,4-5,8-9H2,(H,17,18)/t12-,15-/m0/s1
InChIKey FHMDGQZWWPYAMM-WFASDCNBSA-N
Mol Weight 311.83 g/mol
Molecular Formula C15H18ClNO2S
Exact Mass 311.074678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K6qpdR9sQUu
Name (5S,6S)-6-(4-Chloro-butyl)-5-hydroxy-4-phenylsulfanyl-5,6-dihydro-1H-pyridin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18ClNO2S
InChI InChI=1S/C15H18ClNO2S/c16-9-5-4-8-12-15(19)13(10-14(18)17-12)20-11-6-2-1-3-7-11/h1-3,6-7,10,12,15,19H,4-5,8-9H2,(H,17,18)/t12-,15-/m0/s1
InChIKey FHMDGQZWWPYAMM-WFASDCNBSA-N
Molecular Weight 311.827 g/mol
SMILES N1C(C=C([C@]([C@@]1(CCCCCl)[H])(O)[H])Sc1ccccc1)=O
SPLASH splash10-00di-0900000000-38d69dff2065b6a2ef8a
Source of Spectrum F4-43-762-6
Synonyms trans-6-(4-Chlorobutyl)-5-hydroxy-4-(phenylthio)-5,6-dihydropyridin-2(1H)-one
Wiley ID 1675393