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Benzo[3,4]cyclobuta[1,2-c]thiophene-4-ol, decahydro-7a-methyl-, 2,2-dioxide, (3a.alpha.,3b.beta.,4.alpha.,7a.alpha.,7b.alpha.)-(.+-.)-
SpectraBase Compound ID 1Tj362J5XMh
InChI InChI=1S/C11H18O3S/c1-11-4-2-3-9(12)10(11)7-5-15(13,14)6-8(7)11/h7-10,12H,2-6H2,1H3
InChIKey BIFZSHOCVIPZIG-UHFFFAOYSA-N
Mol Weight 230.32 g/mol
Molecular Formula C11H18O3S
Exact Mass 230.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 59KG0D9WwgA
Name Benzo[3,4]cyclobuta[1,2-c]thiophene-4-ol, decahydro-7a-methyl-, 2,2-dioxide, (3a.alpha.,3b.beta.,4.alpha.,7a.alpha.,7b.alpha.)-(.+-.)-
CAS Registry Number 99655-43-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O3S
InChI InChI=1S/C11H18O3S/c1-11-4-2-3-9(12)10(11)7-5-15(13,14)6-8(7)11/h7-10,12H,2-6H2,1H3
InChIKey BIFZSHOCVIPZIG-UHFFFAOYSA-N
Molecular Weight 230.322 g/mol
SMILES OC1C2C3CS(CC3C2(CCC1)C)(=O)=O
SPLASH splash10-001j-9100000000-039a5898e774fd9b0823
Source of Spectrum J-50-5819-7
Synonyms 1-Methyl-4-thiatricyclo[5.4.0.0(2,6)]undecan-8-ol 4,4-dioxide 7a-methyldecahydrobenzo[3,4]cyclobuta[1,2-c]thiophen-4-ol 2,2-dioxide
Wiley ID 1231444