SpectraBase Spectrum ID |
D9kVV64EDaT |
Name |
18-nor-16-Oxaandrost-12-ene, 4,4,8-trimethyl-, (5.alpha.)-(.+-.)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
288.245315649 u |
Formula |
C20H32O |
InChI |
InChI=1S/C20H32O/c1-18(2)9-5-10-20(4)16(18)8-11-19(3)15-13-21-12-14(15)6-7-17(19)20/h6,15-17H,5,7-13H2,1-4H3/t15-,16+,17+,19?,20+/m1/s1 |
InChIKey |
SZWCQZBAOMKNSD-HEVLLETASA-N |
Molecular Weight |
288.475 g/mol |
SMILES |
C12([C@@]([C@]3(CCCC([C@@]3(CC2)[H])(C)C)C)(CC=C2[C@]1(COC2)[H])[H])C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.846103 |