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1,3-Dibenzoyl-1,3,3a,4,5,6,7,7a-octahydrobenzo[c]thiophen-3a,7a-diol
SpectraBase Compound ID Lf9jyCjaHLh
InChI InChI=1S/C22H22O4S/c23-17(15-9-3-1-4-10-15)19-21(25)13-7-8-14-22(21,26)20(27-19)18(24)16-11-5-2-6-12-16/h1-6,9-12,19-20,25-26H,7-8,13-14H2
InChIKey ZGCIOSRJHYOGCD-UHFFFAOYSA-N
Mol Weight 382.47 g/mol
Molecular Formula C22H22O4S
Exact Mass 382.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9oY3Lo39jWR
Name 1,3-Dibenzoyl-1,3,3a,4,5,6,7,7a-octahydrobenzo[c]thiophen-3a,7a-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O4S
InChI InChI=1S/C22H22O4S/c23-17(15-9-3-1-4-10-15)19-21(25)13-7-8-14-22(21,26)20(27-19)18(24)16-11-5-2-6-12-16/h1-6,9-12,19-20,25-26H,7-8,13-14H2
InChIKey ZGCIOSRJHYOGCD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19913330611
Molecular Weight 382.474 g/mol
SMILES OC12CCCCC1(O)C(SC2C(c1ccccc1)=O)C(c1ccccc1)=O
SPLASH splash10-0a4i-0900000000-7da186cd415b4e8316d4
Source of Spectrum JF-333-892-5
Synonyms (3a,7a-dihydroxyoctahydrobenzo[c]thiophene-1,3-diyl)bis(phenylmethanone)
Wiley ID 1789710