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

*Links on SpectraBase are not permalinks.

Spiro[4.5]dec-7-ene-8-carboxylic acid, 1-(1,5-dimethyl-4-oxohexyl)-9-hydroxy-4-methyl-, methyl ester, [1R-[1.alpha.(R*),4.beta.,5.beta.(S*)]]-

View entire compound with spectra: 2 MS (GC)

Spiro[4.5]dec-7-ene-8-carboxylic acid, 1-(1,5-dimethyl-4-oxohexyl)-9-hydroxy-4-methyl-, methyl ester, [1R-[1.alpha.(R*),4.beta.,5.beta.(S*)]]-
SpectraBase Compound ID Hod4laZLFTv
InChI InChI=1S/C21H34O4/c1-13(2)18(22)9-6-14(3)17-8-7-15(4)21(17)11-10-16(19(23)12-21)20(24)25-5/h10,13-15,17,19,23H,6-9,11-12H2,1-5H3/t14-,15+,17-,19+,21+/m1/s1
InChIKey WLOJMVRFMHXVIR-UHRLKCEPSA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H34O4
Exact Mass 350.24571 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 8h6gcRCj30J
Name Spiro[4.5]dec-7-ene-8-carboxylic acid, 1-(1,5-dimethyl-4-oxohexyl)-9-hydroxy-4-methyl-, methyl ester, [1R-[1.alpha.(R*),4.beta.,5.beta.(S*)]]-
Alternate Name(s) Methyl (1R,4S,5S,9S)-1-[(1R)-1,5-dimethyl-4-oxohexyl]-9-hydroxy-4-methylspiro[4.5]dec-7-ene-8-carboxylate Methyl (1R,4S,5S,9S,1'R)-1-(1',5'-dimethyl-4'-oxohexyl)-9-hydroxy-4-methyl-spiro[4.5]dec-7-ene-8-carboxylate Methyl ester of dihydroxyacorane isoprenologue alcohol
CAS Registry Number 90363-71-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O4
InChI InChI=1S/C21H34O4/c1-13(2)18(22)9-6-14(3)17-8-7-15(4)21(17)11-10-16(19(23)12-21)20(24)25-5/h10,13-15,17,19,23H,6-9,11-12H2,1-5H3/t14-,15+,17-,19+,21+/m1/s1
InChIKey WLOJMVRFMHXVIR-UHRLKCEPSA-N
Molecular Weight 350.499 g/mol
SMILES O[C@]1(C[C@@]2([C@](CC[C@@]2(C)[H])([C@@](CCC(=O)C(C)C)(C)[H])[H])CC=C1C(=O)OC)[H]
SPLASH splash10-05fr-7954000000-05a0fe356643b74abb1e
Source of Spectrum B-37-642-0
Wiley ID 1342142