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

*Links on SpectraBase are not permalinks.
(3aS*,4R*,7S*,7aR*)-3,3-Dimethyl-3a,4,7,7a-tetrahydro-4,7-methanoisobenzofuran-1(3H)-one
SpectraBase Compound ID KrRED6oF3vN
InChI InChI=1S/C11H14O2/c1-11(2)9-7-4-3-6(5-7)8(9)10(12)13-11/h3-4,6-9H,5H2,1-2H3/t6-,7-,8-,9+/m1/s1
InChIKey RWVWXFNXAFQZPP-BGZDPUMWSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 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 A8fqoxJPoi7
Name (3aS*,4R*,7S*,7aR*)-3,3-Dimethyl-3a,4,7,7a-tetrahydro-4,7-methanoisobenzofuran-1(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-11(2)9-7-4-3-6(5-7)8(9)10(12)13-11/h3-4,6-9H,5H2,1-2H3/t6-,7-,8-,9+/m1/s1
InChIKey RWVWXFNXAFQZPP-BGZDPUMWSA-N
Molecular Weight 178.231 g/mol
SMILES C1([C@]2([C@]([C@]3(C[C@]2(C=C3)[H])[H])(C(C)(C)O1)[H])[H])=O
SPLASH splash10-014i-9300000000-5eb05a2f8b631ac1652d
Source of Spectrum U1-2012-6644-36
Synonyms (3aS,4R,7S,7aR)-3,3-dimethyl-3a,4,7,7a-tetrahydro-4,7-methanoisobenzofuran-1(3H)-one
Wiley ID 1735625