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

*Links on SpectraBase are not permalinks.
cis(3,3a)-3-cyclopentyl cis(3a,7a)-3a,4,5,6,7,7a(3H)-hexahydroisobenzofuran-1-one
SpectraBase Compound ID G9SqE3Kb38G
InChI InChI=1S/C13H20O2/c14-13-11-8-4-3-7-10(11)12(15-13)9-5-1-2-6-9/h9-12H,1-8H2/t10-,11+,12+/m1/s1
InChIKey QDUWUSATGQCYRV-WOPDTQHZSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 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 85t9Ed4fBL
Name cis(3,3a)-3-cyclopentyl cis(3a,7a)-3a,4,5,6,7,7a(3H)-hexahydroisobenzofuran-1-one
Alternate Name(s) (3S,3aR,7aS)-3-cyclopentylhexahydro-2-benzofuran-1(3H)-one
CAS Registry Number 103421-13-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c14-13-11-8-4-3-7-10(11)12(15-13)9-5-1-2-6-9/h9-12H,1-8H2/t10-,11+,12+/m1/s1
InChIKey QDUWUSATGQCYRV-WOPDTQHZSA-N
Molecular Weight 208.301 g/mol
SMILES C1(O[C@]([C@@]2(CCCC[C@]12[H])[H])(C1CCCC1)[H])=O
SPLASH splash10-000l-2900000000-c192e30e04aa5d44cd85
Source of Spectrum F-41-3703-16
Wiley ID 1207215