| SpectraBase Spectrum ID |
FdXaXwlqPxc |
| Name |
D:A-Friedooleanan-7-one, 3-hydroxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
442.381080848 u |
| Formula |
C30H50O2 |
| InChI |
InChI=1S/C30H50O2/c1-19-20(31)9-10-22-27(5)14-16-29(7)23-18-25(2,3)11-12-26(23,4)13-15-30(29,8)24(27)21(32)17-28(19,22)6/h19-20,22-24,31H,9-18H2,1-8H3 |
| InChIKey |
ZWTVCIIJDNEQDU-UHFFFAOYSA-N |
| Molecular Weight |
442.728 g/mol |
| SMILES |
C12(C)C3C(C)(C4C(CC3=O)(C)C(C)C(CC4)O)CCC2(C)C2C(CC1)(C)CCC(C2)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.871484 |
