| SpectraBase Spectrum ID |
IOFmFI6IY8h |
| Name |
15-nor-Labda-8(17),12E-dien-14,19-dioic acid |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H28O4 |
| InChI |
InChI=1S/C19H28O4/c1-12-7-9-15-18(3,10-5-11-19(15,4)17(22)23)14(12)8-6-13(2)16(20)21/h6,14-15H,1,5,7-11H2,2-4H3,(H,20,21)(H,22,23)/b13-6+/t14-,15+,18+,19-/m0/s1 |
| InChIKey |
JXHQWTYFUSHCGX-LLIRKGQASA-N |
| Instrument Name |
Hitachi 4000H double-focusing |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np020258y |
| Molecular Weight |
320.429 g/mol |
| Optical Rotation |
[a]D23 = +82.8 (c = 0.80, CHCl3) |
| Reported Formula |
C19H28O4 |
| SMILES |
OC([C@]1(CCC[C@@]2([C@@](C\C=C\(C(O)=O)C)(C(CC[C@@]12[H])=C)[H])C)C)=O |
| SPLASH |
splash10-0006-9643000000-67a03b3c06708d249b3a |
| Source of Spectrum |
G4-65-1923-1 |
| Wiley ID |
1883554 |
