For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(3aR,8bR)-7-Hydroxy-5-phenylsulfanyl-3a,8b-dihydro-3H-benzo[b]furo[2,3-d]furan-2-one
SpectraBase Compound ID GLM7ngQUNTy
InChI InChI=1S/C16H12O4S/c17-9-6-11-15-12(8-14(18)20-15)19-16(11)13(7-9)21-10-4-2-1-3-5-10/h1-7,12,15,17H,8H2/t12-,15-/m1/s1
InChIKey DHVVSUDKMKJEAM-IUODEOHRSA-N
Mol Weight 300.33 g/mol
Molecular Formula C16H12O4S
Exact Mass 300.04563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6a2jb9kzhaE
Name (3aR,8bR)-7-Hydroxy-5-phenylsulfanyl-3a,8b-dihydro-3H-benzo[b]furo[2,3-d]furan-2-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O4S
InChI InChI=1S/C16H12O4S/c17-9-6-11-15-12(8-14(18)20-15)19-16(11)13(7-9)21-10-4-2-1-3-5-10/h1-7,12,15,17H,8H2/t12-,15-/m1/s1
InChIKey DHVVSUDKMKJEAM-IUODEOHRSA-N
Molecular Weight 300.328 g/mol
SMILES Oc1cc(c2c([C@@]3([C@](CC(O3)=O)([H])O2)[H])c1)Sc1ccccc1
SPLASH splash10-0zfr-0049000000-6b5999b9c7bcb9150f23
Source of Spectrum F-53-7728-32
Synonyms (3aR,8bR)-7-hydroxy-5-(phenylsulfanyl)-3a,8b-dihydrofuro[3,2-b][1]benzofuran-2(3H)-one (3aS*,8bS*)-Dihydro-5-phenylsulfonyl-7-hydroxyfuro[3,2-b]benzo[2,1-d]furan-2(3H)-one
Wiley ID 802317