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1H-4-(.beta.-trimethylacetoxyethyl)-2-benzothiopyran
SpectraBase Compound ID HfsVCQQfI8T
InChI InChI=1S/C16H20O2S/c1-16(2,3)15(17)18-9-8-13-11-19-10-12-6-4-5-7-14(12)13/h4-7,11H,8-10H2,1-3H3
InChIKey KIQFOHPGTTVRLG-UHFFFAOYSA-N
Mol Weight 276.39 g/mol
Molecular Formula C16H20O2S
Exact Mass 276.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CtZzJj638Lb
Name 1H-4-(.beta.-trimethylacetoxyethyl)-2-benzothiopyran
Comments Less than 3 mono-isotopic peaks
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Formula C16H20O2S
InChI InChI=1S/C16H20O2S/c1-16(2,3)15(17)18-9-8-13-11-19-10-12-6-4-5-7-14(12)13/h4-7,11H,8-10H2,1-3H3
InChIKey KIQFOHPGTTVRLG-UHFFFAOYSA-N
Molecular Weight 276.394 g/mol
SMILES C(C(C)(C)C)(=O)OCCC=1c2c(cccc2)CSC1
SPLASH splash10-00di-0900000000-a8493179427052020f99
Source of Spectrum F-54-8213-13
Synonyms 2-(1H-2-benzothiopyran-4-yl)ethyl pivalate
Wiley ID 807809