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Bicyclo[2.2.2]oct-5-ene-2-carboxylic acid, 2-(methylthio)-
SpectraBase Compound ID 4Rh2mi3AKQv
InChI InChI=1S/C10H14O2S/c1-13-10(9(11)12)6-7-2-4-8(10)5-3-7/h2,4,7-8H,3,5-6H2,1H3,(H,11,12)
InChIKey TYTQHDJNVONNEO-UHFFFAOYSA-N
Mol Weight 198.28 g/mol
Molecular Formula C10H14O2S
Exact Mass 198.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ZpPfb8n9sg
Name Bicyclo[2.2.2]oct-5-ene-2-carboxylic acid, 2-(methylthio)-
CAS Registry Number 63088-20-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O2S
InChI InChI=1S/C10H14O2S/c1-13-10(9(11)12)6-7-2-4-8(10)5-3-7/h2,4,7-8H,3,5-6H2,1H3,(H,11,12)
InChIKey TYTQHDJNVONNEO-UHFFFAOYSA-N
Molecular Weight 198.280 g/mol
SMILES OC(C1(C2C=CC(C1)CC2)SC)=O
SPLASH splash10-003r-9100000000-1a750f8377b9e60c31d0
Source of Spectrum C-99-3108-0
Synonyms 2-(methylsulfanyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid 2-Carboxy-2-methylthiobicyclo(2.2.2)oct-5-ene
Wiley ID 1195141