| SpectraBase Compound ID | 2kud8IZYmDv |
|---|---|
| InChI | InChI=1S/C24H40/c1-17-7-8-20-23(5,15-17)10-9-18-19-16-21(2,3)11-12-22(19,4)13-14-24(18,20)6/h17,20H,7-16H2,1-6H3/t17-,20?,22+,23-,24-/m0/s1 |
| InChIKey | FEYKAKGZUVLGEG-DKKPUSLXSA-N |
| Mol Weight | 328.6 g/mol |
| Molecular Formula | C24H40 |
| Exact Mass | 328.313001 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9cDEq1rumCv |
|---|---|
| Name | (2S,4br,6ar,12As)-2,4B,6A,9,9,12A-hexamethyl-1,2,3,4,4A,4B,5,6,6A,7,8,9,10,11,12,12A-hexadecahydrochrysene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.313001288 u |
| Formula | C24H40 |
| InChI | InChI=1S/C24H40/c1-17-7-8-20-23(5,15-17)10-9-18-19-16-21(2,3)11-12-22(19,4)13-14-24(18,20)6/h17,20H,7-16H2,1-6H3/t17-,20?,22+,23-,24-/m0/s1 |
| InChIKey | FEYKAKGZUVLGEG-DKKPUSLXSA-N |
| Molecular Weight | 328.584 g/mol |
| SMILES | C1[C@](CCC2[C@]1(CCC=1[C@@]2(CC[C@@]2(C1CC(CC2)(C)C)C)C)C)(C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.837953 |