| SpectraBase Spectrum ID |
DVJaQYkrvm9 |
| Name |
19-Norcholestane, (10.xi.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
358.359951481 u |
| Formula |
C26H46 |
| InChI |
InChI=1S/C26H46/c1-18(2)8-7-9-19(3)24-14-15-25-23-13-12-20-10-5-6-11-21(20)22(23)16-17-26(24,25)4/h18-25H,5-17H2,1-4H3/t19-,20?,21+,22-,23-,24-,25+,26-/m1/s1 |
| InChIKey |
DIEIYOCAHJJDBL-CGLPLZRSSA-N |
| Molecular Weight |
358.654 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CCC4[C@@]([C@]3(CC2)[H])(CCCC4)[H])[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.889893 |
