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3-Acetyl-3-methyl-2-thiabicyclo[2.2.1]hept-5-ene
SpectraBase Compound ID G5YLH2iAAbU
InChI InChI=1S/C9H12OS/c1-6(10)9(2)7-3-4-8(5-7)11-9/h3-4,7-8H,5H2,1-2H3
InChIKey ZIGIUGLWZQRBQK-UHFFFAOYSA-N
Mol Weight 168.25 g/mol
Molecular Formula C9H12OS
Exact Mass 168.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5RD5tLPNiXK
Name 3-Acetyl-3-methyl-2-thiabicyclo[2.2.1]hept-5-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12OS
InChI InChI=1S/C9H12OS/c1-6(10)9(2)7-3-4-8(5-7)11-9/h3-4,7-8H,5H2,1-2H3
InChIKey ZIGIUGLWZQRBQK-UHFFFAOYSA-N
Molecular Weight 168.254 g/mol
SMILES C1(SC2CC1C=C2)(C(=O)C)C
SPLASH splash10-0aor-9400000000-9cc23562a92d3a506ca8
Source of Spectrum AT-31-6184-4
Synonyms 1-(3-Methyl-2-thiabicyclo[2.2.1]hept-5-en-3-yl)ethanone
Wiley ID 835844