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1H-4-(.beta.-thioacetoxyethyl)-2-benzothiopyran
SpectraBase Compound ID BpZLsWV7vlJ
InChI InChI=1S/C13H14OS2/c1-10(14)16-7-6-12-9-15-8-11-4-2-3-5-13(11)12/h2-5,9H,6-8H2,1H3
InChIKey DPRLXVOGUOATKR-UHFFFAOYSA-N
Mol Weight 250.37 g/mol
Molecular Formula C13H14OS2
Exact Mass 250.048607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WJFIouY5Tp
Name 1H-4-(.beta.-thioacetoxyethyl)-2-benzothiopyran
Comments Less than 3 mono-isotopic peaks
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Formula C13H14OS2
InChI InChI=1S/C13H14OS2/c1-10(14)16-7-6-12-9-15-8-11-4-2-3-5-13(11)12/h2-5,9H,6-8H2,1H3
InChIKey DPRLXVOGUOATKR-UHFFFAOYSA-N
Molecular Weight 250.374 g/mol
SMILES C=1(c2c(cccc2)CSC1)CCSC(=O)C
SPLASH splash10-00di-0910000000-4dec834976391ce8c98c
Source of Spectrum F-54-8213-14
Synonyms S-[2-(1H-2-benzothiopyran-4-yl)ethyl]ethanethioate
Wiley ID 807806