| SpectraBase Spectrum ID |
9Q9bJ6CCQAl |
| Name |
2-Ethyl-trans-4A,cis-4B,trans-8A,cis-10A-perhydro-trans-2,4A,8A-trimethylphenanthren-8-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
276.245315649 u |
| Formula |
C19H32O |
| InChI |
InChI=1S/C19H32O/c1-5-17(2)11-12-18(3)14(13-17)9-10-19(4)15(18)7-6-8-16(19)20/h14-15H,5-13H2,1-4H3 |
| InChIKey |
KAFOMEHUQZXFOK-UHFFFAOYSA-N |
| Molecular Weight |
276.464 g/mol |
| SMILES |
C1CC(C2(C(C1)C1(C(CC2)CC(C)(CC)CC1)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956589 |
