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7-Chloro-2-ethylthio-4-oxo-4H-1-benzothiin-3-carbaldehyde
SpectraBase Compound ID Dmnui9yz4zJ
InChI InChI=1S/C12H9ClO2S2/c1-2-16-12-9(6-14)11(15)8-4-3-7(13)5-10(8)17-12/h3-6H,2H2,1H3
InChIKey NWANONTVZPCMDI-UHFFFAOYSA-N
Mol Weight 284.78 g/mol
Molecular Formula C12H9ClO2S2
Exact Mass 283.97325 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58WyNtPKyGd
Name 7-Chloro-2-ethylthio-4-oxo-4H-1-benzothiin-3-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9ClO2S2
InChI InChI=1S/C12H9ClO2S2/c1-2-16-12-9(6-14)11(15)8-4-3-7(13)5-10(8)17-12/h3-6H,2H2,1H3
InChIKey NWANONTVZPCMDI-UHFFFAOYSA-N
Molecular Weight 284.775 g/mol
SMILES C=1(Sc2c(C(C1C=O)=O)ccc(c2)Cl)SCC
SPLASH splash10-004i-0090000000-5ea39da8eb0abd3548a5
Source of Spectrum SO-0-668-4
Synonyms 7-Chloro-2-(ethylsulfanyl)-4-oxo-4H-1-benzothiopyran-3-carbaldehyde
Wiley ID 1543427