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4H-Thiopyran-3-carboxylic acid, 4-oxo-, 2-propenyl ester
SpectraBase Compound ID 3ZNL260xqio
InChI InChI=1S/C9H8O3S/c1-2-4-12-9(11)7-6-13-5-3-8(7)10/h2-3,5-6H,1,4H2
InChIKey MXALVDYLFYFZAX-UHFFFAOYSA-N
Mol Weight 196.22 g/mol
Molecular Formula C9H8O3S
Exact Mass 196.019415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HaN4GT0on5i
Name 4H-Thiopyran-3-carboxylic acid, 4-oxo-, 2-propenyl ester
CAS Registry Number 117169-55-8
Comments Less than 3 mono-isotopic peaks
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Formula C9H8O3S
InChI InChI=1S/C9H8O3S/c1-2-4-12-9(11)7-6-13-5-3-8(7)10/h2-3,5-6H,1,4H2
InChIKey MXALVDYLFYFZAX-UHFFFAOYSA-N
Molecular Weight 196.220 g/mol
SMILES C=1(C(=O)OCC=C)C(C=CSC1)=O
SPLASH splash10-000i-0900000000-8551a804f8973ba88170
Source of Spectrum F-45-462-2
Synonyms 3-Allyloxycarbonylthin-4-one allyl 4-oxo-4H-thiopyran-3-carboxylate
Wiley ID 1192593