| SpectraBase Spectrum ID |
GIamJAmPMcb |
| Name |
Androst-5-ene-3,17-diol, 17-methyl-, diacetate, (3.beta.,17.beta.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.261359635 u |
| Formula |
C24H36O4 |
| InChI |
InChI=1S/C24H36O4/c1-15(25)27-18-8-11-22(3)17(14-18)6-7-19-20(22)9-12-23(4)21(19)10-13-24(23,5)28-16(2)26/h6,18-21H,7-14H2,1-5H3/t18-,19+,20-,21-,22-,23-,24+/m0/s1 |
| InChIKey |
HHCVPHSEENQSLU-DAVSBLIESA-N |
| Molecular Weight |
388.548 g/mol |
| SMILES |
[C@@]1(CC=2[C@](CC1)([C@@]1([C@@](CC2)([C@]2([C@](CC1)([C@@](OC(C)=O)(C)CC2)C)[H])[H])[H])C)(OC(C)=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970443 |
