| SpectraBase Spectrum ID |
JwFj0nROAyi |
| Name |
Labda-8(17),13-dien-15-oic acid, 3.beta.-acetoxy-, methyl ester, (13E)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
376.261359635 u |
| Formula |
C23H36O4 |
| InChI |
InChI=1S/C23H36O4/c1-15(14-21(25)26-7)8-10-18-16(2)9-11-19-22(4,5)20(27-17(3)24)12-13-23(18,19)6/h14,18-20H,2,8-13H2,1,3-7H3/b15-14+ |
| InChIKey |
LODVZNAZFNRTCG-CCEZHUSRSA-N |
| Molecular Weight |
376.537 g/mol |
| SMILES |
C12C(C(CCC2(C(C(CC1)=C)CC\C(C)=C\C(=O)OC)C)OC(=O)C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97697 |
