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

*Links on SpectraBase are not permalinks.
(1S,2S,5R,6S,7S)-2-hydroxy-5,7-dimethyl-2'-spiro[8-oxabicyclo[5.1.0]octane-6,5'-oxolane]one
SpectraBase Compound ID 7VXCHarPRcL
InChI InChI=1S/C12H18O4/c1-7-3-4-8(13)10-11(2,16-10)12(7)6-5-9(14)15-12/h7-8,10,13H,3-6H2,1-2H3/t7-,8+,10+,11+,12+/m1/s1
InChIKey WJYSCAHZZVKFOK-MZPHRCEOSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 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 L9DQQ6v0tcB
Name (1S,2S,5R,6S,7S)-2-hydroxy-5,7-dimethyl-2'-spiro[8-oxabicyclo[5.1.0]octane-6,5'-oxolane]one
CAS Registry Number 116661-11-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-7-3-4-8(13)10-11(2,16-10)12(7)6-5-9(14)15-12/h7-8,10,13H,3-6H2,1-2H3/t7-,8+,10+,11+,12+/m1/s1
InChIKey WJYSCAHZZVKFOK-MZPHRCEOSA-N
Molecular Weight 226.272 g/mol
SMILES O[C@@]1([C@]2([C@](O2)([C@@]2(OC(=O)CC2)[C@@](CC1)(C)[H])C)[H])[H]
SPLASH splash10-0a4i-9400000000-12a5612995968719e92f
Source of Spectrum F-43-5295-18
Synonyms (1S,2S,5R,6S,7S)-2-hydroxy-5,7-dimethyl-spiro[8-oxabicyclo[5.1.0]octane-6,5'-tetrahydrofuran]-2'-one (1S,2S,5R,6S,7S)-2-hydroxy-5,7-dimethylspiro[8-oxabicyclo[5.1.0]octane-6,5'-oxolane]-2'-one (1S,2S,5R,6S,7S)-5,7-dimethyl-2-oxidanyl-spiro[8-oxabicyclo[5.1.0]octane-6,5'-oxolane]-2'-one
Wiley ID 1227285