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7-Chloro-2-benzylthio-4-oxo-4H-1-benzothiin-3-carbaldehyde
SpectraBase Compound ID DcvGXWQcZLv
InChI InChI=1S/C17H11ClO2S2/c18-12-6-7-13-15(8-12)22-17(14(9-19)16(13)20)21-10-11-4-2-1-3-5-11/h1-9H,10H2
InChIKey JSLUDRXYBVZUHQ-UHFFFAOYSA-N
Mol Weight 346.85 g/mol
Molecular Formula C17H11ClO2S2
Exact Mass 345.9889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2JU9SzUg42
Name 7-Chloro-2-benzylthio-4-oxo-4H-1-benzothiin-3-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11ClO2S2
InChI InChI=1S/C17H11ClO2S2/c18-12-6-7-13-15(8-12)22-17(14(9-19)16(13)20)21-10-11-4-2-1-3-5-11/h1-9H,10H2
InChIKey JSLUDRXYBVZUHQ-UHFFFAOYSA-N
Molecular Weight 346.846 g/mol
SMILES C=1(Sc2c(C(C1C=O)=O)ccc(c2)Cl)SCc1ccccc1
SPLASH splash10-0a4i-0097000000-4b689b94bb6632c13c51
Source of Spectrum SO-0-668-4
Synonyms 2-(benzylsulfanyl)-7-chloro-4-oxo-4H-1-benzothiopyran-3-carbaldehyde
Wiley ID 1543425