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

*Links on SpectraBase are not permalinks.
Spiro[benzofuran-2(3H),2'-[2H]pyran]-3-one, 3',3a,4,4',5,5',6',7a-octahydro-, (2.alpha.,3a.beta.,7a.beta.)-(.+-.)-
SpectraBase Compound ID 2J8p4AQ2aTO
InChI InChI=1S/C12H16O3/c13-11-9-5-1-2-6-10(9)15-12(11)7-3-4-8-14-12/h2,6,9-10H,1,3-5,7-8H2/t9-,10-,12-/m1/s1
InChIKey YMLUAYWUNYVGPQ-CKYFFXLPSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 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 6wCVcKsn22T
Name Spiro[benzofuran-2(3H),2'-[2H]pyran]-3-one, 3',3a,4,4',5,5',6',7a-octahydro-, (2.alpha.,3a.beta.,7a.beta.)-(.+-.)-
CAS Registry Number 95340-80-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c13-11-9-5-1-2-6-10(9)15-12(11)7-3-4-8-14-12/h2,6,9-10H,1,3-5,7-8H2/t9-,10-,12-/m1/s1
InChIKey YMLUAYWUNYVGPQ-CKYFFXLPSA-N
Molecular Weight 208.257 g/mol
SMILES [C@@]12(C([C@@]3(CCC=C[C@]3(O2)[H])[H])=O)OCCCC1
SPLASH splash10-0ue9-6900000000-65a9c659396f3dfed511
Source of Spectrum J-50-1116-3
Synonyms (2.alpha.,3a.beta.,7a.beta.)-(+-)-3a,4,5,7a,3',4',5',6'-octahydro-3-oxospiro[benzofuran-2(3H),2'-[2H]pyran] (2R,3aR,7aR)-3a,4,5,7a-tetrahydro-3H-spiro[1-benzofuran-2,2'-oxane]-3-one
Wiley ID 1206901