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3,4-Benzo-2-thiatricyclo(4.3.1.0)dec-3-en-5-one

View entire compound with spectra: 1 MS (GC)

3,4-Benzo-2-thiatricyclo(4.3.1.0)dec-3-en-5-one
SpectraBase Compound ID F4GH2HueKrM
InChI InChI=1S/C13H12OS/c14-11-9-4-1-2-5-10(9)15-13-7-3-6-12(11,13)8-13/h1-2,4-5H,3,6-8H2
InChIKey RMHQTQMPLJWNQF-UHFFFAOYSA-N
Mol Weight 216.3 g/mol
Molecular Formula C13H12OS
Exact Mass 216.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ibck0TDPsv
Name 3,4-Benzo-2-thiatricyclo(4.3.1.0)dec-3-en-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12OS
InChI InChI=1S/C13H12OS/c14-11-9-4-1-2-5-10(9)15-13-7-3-6-12(11,13)8-13/h1-2,4-5H,3,6-8H2
InChIKey RMHQTQMPLJWNQF-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 216.298 g/mol
SMILES c1ccc2c(c1)SC13C(C2=O)(CCC3)C1
SPLASH splash10-0uxr-3890000000-83370c16b8061dd73f3e
Source of Spectrum SRH-2022-5549-0
Wiley ID 1827607