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2-Acetylthio-5-methylbenzoylmethyl 2-.alpha.-chloroacetyl-4-methylphenyl sulfide
SpectraBase Compound ID DUdafXIyFm4
InChI InChI=1S/C20H19ClO3S2/c1-12-4-6-19(15(8-12)17(23)10-21)25-11-18(24)16-9-13(2)5-7-20(16)26-14(3)22/h4-9H,10-11H2,1-3H3
InChIKey ZCCBPZNUZSBYJR-UHFFFAOYSA-N
Mol Weight 406.94 g/mol
Molecular Formula C20H19ClO3S2
Exact Mass 406.046415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3oAQ1JNa0c9
Name 2-Acetylthio-5-methylbenzoylmethyl 2-.alpha.-chloroacetyl-4-methylphenyl sulfide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19ClO3S2
InChI InChI=1S/C20H19ClO3S2/c1-12-4-6-19(15(8-12)17(23)10-21)25-11-18(24)16-9-13(2)5-7-20(16)26-14(3)22/h4-9H,10-11H2,1-3H3
InChIKey ZCCBPZNUZSBYJR-UHFFFAOYSA-N
Molecular Weight 406.942 g/mol
SMILES c1(c(SC(=O)C)ccc(c1)C)C(CSc1c(C(=O)CCl)cc(cc1)C)=O
SPLASH splash10-0006-0900000000-c0e4fb95fb49a759cf13
Source of Spectrum QB-21-799-8
Synonyms 2-Acetylthio-4-methylbenzoylmethyl 2-.alpha.-chloroacetyl-4-methylphenyl sulfide S-[2-({[2-(chloroacetyl)-4-methylphenyl]sulfanyl}acetyl)-4-methylphenyl]ethanethioate
Wiley ID 860562