| SpectraBase Spectrum ID |
FR7UIpBZDo8 |
| Name |
17-Norkaur-2-ene-13-carboxylic acid, methyl ester, (8.beta.,13.beta.)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
316.240230268 u |
| Formula |
C21H32O2 |
| InChI |
InChI=1S/C21H32O2/c1-18(2)8-5-9-19(3)15(18)6-10-20-12-13-21(14-20,17(22)23-4)11-7-16(19)20/h5,8,15-16H,6-7,9-14H2,1-4H3/t15-,16+,19-,20-,21+/m0/s1 |
| InChIKey |
WZYIPVTZXPOYDT-CEDHKZHLSA-N |
| Molecular Weight |
316.485 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]4(C[C@](CC3)(C(=O)OC)CC4)CC[C@]2(C(C)(C)C=CC1)[H])[H])C |
