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

*Links on SpectraBase are not permalinks.

1-Phenanthrenecarboxylic acid, tetradecahydro-1,4a-dimethyl-7-(1-methylethylidene)-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,8a.beta.,10a.alpha.)]-

View entire compound with spectra: 1 NMR, and 2 MS (GC)

1-Phenanthrenecarboxylic acid, tetradecahydro-1,4a-dimethyl-7-(1-methylethylidene)-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,8a.beta.,10a.alpha.)]-
SpectraBase Compound ID LErt6cV9MJj
InChI InChI=1S/C21H34O2/c1-14(2)15-7-9-17-16(13-15)8-10-18-20(17,3)11-6-12-21(18,4)19(22)23-5/h16-18H,6-13H2,1-5H3
InChIKey SBZPTBZWCRIWIE-UHFFFAOYSA-N
Mol Weight 318.5 g/mol
Molecular Formula C21H34O2
Exact Mass 318.25588 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 67Qw7eBjD6n
Name 1-Phenanthrenecarboxylic acid, tetradecahydro-1,4A-dimethyl-7-(1-methylethylidene)-, methyl ester, [1R-(1.alpha.,4A.beta.,4B.alpha.,8A.beta.,10A.alpha.)]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.255880333 u
Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-14(2)15-7-9-17-16(13-15)8-10-18-20(17,3)11-6-12-21(18,4)19(22)23-5/h16-18H,6-13H2,1-5H3
InChIKey SBZPTBZWCRIWIE-UHFFFAOYSA-N
Molecular Weight 318.501 g/mol
SMILES C12C(CCCC2(C2C(CC1)CC(=C(C)C)CC2)C)(C)C(OC)=O