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ALLYL-3,4-DIHYDRO-4-OXO-2H-THIINE-3-CARBOXYLATE;KETO-FORM
SpectraBase Compound ID BBVKh3uJHLE
InChI InChI=1S/C9H10O3S/c1-2-4-12-9(11)7-6-13-5-3-8(7)10/h2-3,5,7H,1,4,6H2
InChIKey GLVDWESNFFPLDC-UHFFFAOYSA-N
Mol Weight 198.24 g/mol
Molecular Formula C9H10O3S
Exact Mass 198.035065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIYRZULQAua
Name Allyl 3,4-dihydro-4-oxo-2H-thiine-3-carboxylate
Alternate Name(s) Allyl 4-oxo-3,4-dihydro-2H-thiopyran-3-carboxylate 4-Oxo-2,3-dihydrothiopyran-3-carboxylic acid prop-2-enyl ester Prop-2-enyl 4-oxo-2,3-dihydrothiopyran-3-carboxylate Allyl 4-oxo-2,3-dihydrothiopyran-3-carboxylate Prop-2-enyl 4-oxidanylidene-2,3-dihydrothiopyran-3-carboxylate
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Formula C9H10O3S
InChI InChI=1S/C9H10O3S/c1-2-4-12-9(11)7-6-13-5-3-8(7)10/h2-3,5,7H,1,4,6H2
InChIKey GLVDWESNFFPLDC-UHFFFAOYSA-N
Molecular Weight 198.236 g/mol
SMILES C1(C(=O)OCC=C)C(C=CSC1)=O
SPLASH splash10-03di-0900000000-c1698c1191044252b430
Source of Spectrum KC-0-2317-6
Wiley ID 779778