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

*Links on SpectraBase are not permalinks.
3-Oxabicyclo[3.3.1]nonane-2-acetic acid, 9,9-dimethyl-8-methylene-, methyl ester, endo-(.+-.)-
SpectraBase Compound ID IXNA2nQt3sa
InChI InChI=1S/C14H22O3/c1-8-5-6-10-7-17-12(9(2)13(15)16)11(8)14(10,3)4/h9-12H,1,5-7H2,2-4H3,(H,15,16)/t9?,10-,11+,12?/m1/s1
InChIKey NUKMZQKSOMAWOA-UPOSSJBDSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 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 3uPYkFEcF8b
Name 3-Oxabicyclo[3.3.1]nonane-2-acetic acid, 9,9-dimethyl-8-methylene-, methyl ester, endo-(.+-.)-
CAS Registry Number 121979-49-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-8-5-6-10-7-17-12(9(2)13(15)16)11(8)14(10,3)4/h9-12H,1,5-7H2,2-4H3,(H,15,16)/t9?,10-,11+,12?/m1/s1
InChIKey NUKMZQKSOMAWOA-UPOSSJBDSA-N
Molecular Weight 238.327 g/mol
SMILES OC(C(C1[C@]2(C(C)(C)[C@@](CO1)(CCC2=C)[H])[H])C)=O
SPLASH splash10-00dl-6910000000-15041833bf8b8d729138
Source of Spectrum H-71-621-5
Synonyms (+-)-Methyl (9',9'-dimethyl-8'-methylidene-3'-oxabicyclo[3.3.1]non-2'-endo-yl)acetate 2-(9,9-dimethyl-8-methylene-3-oxabicyclo[3.3.1]non-2-yl)propanoic acid
Wiley ID 1240796