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3-Allyloxycarbonyl-4-thianone

View entire compound with spectra: 1 MS (GC)

3-Allyloxycarbonyl-4-thianone
SpectraBase Compound ID 6XqJClpYtZL
InChI InChI=1S/C9H12O3S/c1-2-4-12-9(11)7-6-13-5-3-8(7)10/h2,7H,1,3-6H2
InChIKey JGLWZMDDMFCUOB-UHFFFAOYSA-N
Mol Weight 200.25 g/mol
Molecular Formula C9H12O3S
Exact Mass 200.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID omtZKxPdLy
Name 3-Allyloxycarbonyl-4-thianone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3S
InChI InChI=1S/C9H12O3S/c1-2-4-12-9(11)7-6-13-5-3-8(7)10/h2,7H,1,3-6H2
InChIKey JGLWZMDDMFCUOB-UHFFFAOYSA-N
Molecular Weight 200.252 g/mol
SMILES C1(C(=O)OCC=C)C(=O)CCSC1
SPLASH splash10-052f-9410000000-7f2c7f7234d8aab1efe9
Source of Spectrum SO-0-769-1
Synonyms Allyl 4-oxotetrahydro-2H-thiopyran-3-carboxylate 4-Oxo-3-thianecarboxylic acid prop-2-enyl ester Prop-2-enyl 4-oxothiane-3-carboxylate Allyl 4-oxotetrahydrothiopyran-3-carboxylate Prop-2-enyl 4-oxidanylidenethiane-3-carboxylate
Wiley ID 1540967