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Benzofuran, octahydro-3a-(phenylthio)-, cis-
SpectraBase Compound ID 6jxZMUZMaKg
InChI InChI=1S/C14H18OS/c1-2-6-12(7-3-1)16-14-9-5-4-8-13(14)15-11-10-14/h1-3,6-7,13H,4-5,8-11H2/t13-,14+/m0/s1
InChIKey ZJJFFNDXQNHBDI-UONOGXRCSA-N
Mol Weight 234.36 g/mol
Molecular Formula C14H18OS
Exact Mass 234.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmyHIkUGHvd
Name Benzofuran, octahydro-3a-(phenylthio)-, cis-
Alternate Name(s) (3aR,7aS)-3a-(phenylsulfanyl)octahydro-1-benzofuran (3aR,7aS)-hexahydro-1-benzofuran-3a(4H)-yl phenyl sulfide 1-Oxa-3a-phenylthiobicylo[4.3.0]nonane
CAS Registry Number 111017-33-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18OS
InChI InChI=1S/C14H18OS/c1-2-6-12(7-3-1)16-14-9-5-4-8-13(14)15-11-10-14/h1-3,6-7,13H,4-5,8-11H2/t13-,14+/m0/s1
InChIKey ZJJFFNDXQNHBDI-UONOGXRCSA-N
Molecular Weight 234.357 g/mol
SMILES [C@@]12(Sc3ccccc3)[C@@](OCC1)(CCCC2)[H]
SPLASH splash10-0a6r-9600000000-93eb2d4a181a5fdc71e5
Source of Spectrum F-44-4396-4
Wiley ID 1236053