SpectraBase Spectrum ID |
AXtvNStExse |
Name |
D:A-Friedooleanan-29-ol, (20.alpha.)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
428.401816293 u |
Formula |
C30H52O |
InChI |
InChI=1S/C30H52O/c1-21-9-8-10-22-27(21,4)12-11-23-28(22,5)16-18-30(7)24-19-25(2,20-31)13-14-26(24,3)15-17-29(23,30)6/h21-24,31H,8-20H2,1-7H3 |
InChIKey |
RAWVXIZECCVKKP-UHFFFAOYSA-N |
Molecular Weight |
428.745 g/mol |
SMILES |
C12(C3C(CCC2(C2C(CC1)(CCC(C2)(C)CO)C)C)(C1C(CC3)(C(CCC1)C)C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.870428 |