PNLKKJYRIDHRFA-KFKHXHHDSA-N
Compound with spectra: 2 NMR
| SpectraBase Compound ID | B2b4EO608on |
|---|---|
| InChI | InChI=1S/2C21H34O3/c2*1-14(16(3)22)8-10-17-15(2)9-11-18-20(17,4)12-7-13-21(18,5)19(23)24-6/h2*8,16-18,22H,2,7,9-13H2,1,3-6H3/b2*14-8+/t2*16?,17-,18?,20+,21-/m00/s1 |
| InChIKey | PNLKKJYRIDHRFA-KFKHXHHDSA-N |
| Mol Weight | 669.0 g/mol |
| Molecular Formula | C42H68O6 |
| Exact Mass | 668.50159 g/mol |
| Enantiomer InChIKey | PNLKKJYRIDHRFA-FZFQHQNESA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
(1S,4aR,5S)-1,4a-dimethyl-6-methylene-5-[(Z)-3-methylpent-2-enyl]decalin-1-carboxylic acid methyl ester
Methyl labda-8(17),12E-dien-19-oate
METHYL COMMUNATE
(1S,4aR,5S)-1,4a-dimethyl-6-methylene-5-[(2Z)-3-methylpenta-2,4-dienyl]decalin-1-carboxylic acid methyl ester
Trans-Communic acid methyl ester
Cis-Communic acid methyl ester
(1S,4aR,5S)-1,4a-dimethyl-6-methylene-5-[(2E)-3-methylpenta-2,4-dienyl]decalin-1-carboxylic acid methyl ester
YVHXAICISSUKQJ-HBVKIBMRSA-N
15-Norlabda-8(17),12(E)-dien-14-carboraldehyde-19-oic acid methyl ester
Methyl 14-oxo-15-nor-labda-8(17),12Z-dien-19-oate
| Title | Journal or Book | Year |
|---|---|---|
| 13C NMR data for labdane diterpenoids | Magnetic Resonance in Chemistry | 1993 |
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.