| SpectraBase Spectrum ID |
INdpBDrVrK6 |
| Name |
17.beta.-Hydroxy-6-pentyl-4-nor-3,5-seco-5-androsten-3-oic acid, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
376.297745145 u |
| Formula |
C24H40O3 |
| InChI |
InChI=1S/C24H40O3/c1-5-6-7-8-17-9-10-18-19-11-12-21(25)24(19,3)15-13-20(18)23(17,2)16-14-22(26)27-4/h9,18-21,25H,5-8,10-16H2,1-4H3 |
| InChIKey |
YOTPPBJBXUOLJP-UHFFFAOYSA-N |
| Molecular Weight |
376.581 g/mol |
| SMILES |
C(CCC1(C(=CCC2C1CCC1(C2CCC1O)C)CCCCC)C)(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969764 |
