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2-Azetidinone, 3-chloro-1-(2-methoxyphenyl)-4-(methylthio)-, (3R-trans)-
SpectraBase Compound ID Gn5hZ3LpbXa
InChI InChI=1S/C11H12ClNO2S/c1-15-8-6-4-3-5-7(8)13-10(14)9(12)11(13)16-2/h3-6,9,11H,1-2H3/t9-,11+/m0/s1
InChIKey RFNFJQHVFWGQCC-GXSJLCMTSA-N
Mol Weight 257.73 g/mol
Molecular Formula C11H12ClNO2S
Exact Mass 257.027728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2aNmLtoNwQq
Name 2-Azetidinone, 3-chloro-1-(2-methoxyphenyl)-4-(methylthio)-, (3R-trans)-
CAS Registry Number 82725-33-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12ClNO2S
InChI InChI=1S/C11H12ClNO2S/c1-15-8-6-4-3-5-7(8)13-10(14)9(12)11(13)16-2/h3-6,9,11H,1-2H3/t9-,11+/m0/s1
InChIKey RFNFJQHVFWGQCC-GXSJLCMTSA-N
Molecular Weight 257.735 g/mol
SMILES C1(N([C@@]([C@]1(Cl)[H])(SC)[H])c1c(OC)cccc1)=O
SPLASH splash10-0002-0900000000-527c15019736cca36b0e
Source of Spectrum AH-113-598-0
Synonyms (3R,4s/3s,4R)-3-chloro-1-(2-methoxyphenyl)-4-methylthio-2-azetidinone (3S,4R)-3-chloro-1-(2-methoxyphenyl)-4-(methylsulfanyl)-2-azetidinone
Wiley ID 1260547