| SpectraBase Spectrum ID |
GNc6DlLdvQK |
| Name |
Methyl 15-nor-ent-halima-1(10),13-dien-18-oate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.240230268 u |
| Formula |
C20H32O2 |
| InChI |
InChI=1S/C20H32O2/c1-14(2)11-13-19(4)15(3)9-10-17-16(19)8-7-12-20(17,5)18(21)22-6/h8,15,17H,1,7,9-13H2,2-6H3/t15-,17+,19+,20+/m1/s1 |
| InChIKey |
XNAGESGXGWLKOS-LQJIQPLVSA-N |
| Molecular Weight |
304.474 g/mol |
| SMILES |
C1=2[C@@]([C@](C(=O)OC)(C)CCC2)(CC[C@]([C@@]1(CCC(=C)C)C)(C)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964942 |