Neoabietic acid methyl ester
Compound with spectra: 1 NMR, and 1 MS (GC)
| SpectraBase Compound ID | 4ZOlwIUJtrX |
|---|---|
| InChI | InChI=1S/C21H32O2/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/h13,17-18H,6-12H2,1-5H3/t17-,18+,20+,21+/m0/s1 |
| InChIKey | XLNYKQDSHLEWFW-UYWIDEMCSA-N |
| Mol Weight | 316.5 g/mol |
| Molecular Formula | C21H32O2 |
| Exact Mass | 316.24023 g/mol |
| Enantiomer InChIKey | XLNYKQDSHLEWFW-ZFMNYDKASA-N |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | RCM-22-3713-Table1,entry29 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
Neoabietic acid TMS
1H-Cyclohepta[a]naphthalene-4-carboxylic acid, 2,3,4,4a,5,6,8,9,10,11,11a,11b-dodecahydro-4,8,9,11b-tetramethyl-, methyl ester
1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,7.beta.,10a.alpha.)]-
1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,9,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,10a.alpha.)]-
(1R,4aR,4bS,7S,10aR)-7-ethyl-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester
1-Phenanthrenecarboxylic acid, 7-ethyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,7.beta.,7a.alpha.)]-
1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,9,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, ethyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,10a.alpha.)]-
1H-Cyclohepta[a]naphthalene-4-carboxylic acid, 2,3,4,4a,5,6,8,11,11a,11b-decahydro-4,8,9,11b-tetramethyl-, methyl ester
1H-Benz[e]indene-6-carboxylic acid, 3-formyl-2,4,5,5a,6,7,8,9,9a,9b-decahydro-6,9a-dimethyl-, methyl ester, (5.alpha.,6.beta.,9a.beta.,9b.alpha.)-(.+-.)-
| Title | Journal or Book | Year |
|---|---|---|
| Sesterterpenoids and Diterpenoids of the Wax Excreted by a Scale Insect, Ceroplastes pseudoceriferus | Journal of Natural Products | 1999 |
This compound is available in the following databases:
Wiley Registry of Mass Spectral Data 2023
Author: Wiley
The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library Learn more.