| SpectraBase Compound ID | CncgXGbBXLd |
|---|---|
| InChI | InChI=1S/C15H24O/c1-10(2)12-6-5-11(3)13-7-8-15(4,16)14(13)9-12/h9-10,13-14,16H,3,5-8H2,1-2,4H3/t13-,14-,15-/m1/s1 |
| InChIKey | BUPJOLXWQXEJSQ-RBSFLKMASA-N |
| Mol Weight | 220.36 g/mol |
| Molecular Formula | C15H24O |
| Exact Mass | 220.182715 g/mol |
| SpectraBase Spectrum ID | 4497gtCi7Gm |
|---|---|
| Name | Alismol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.182715392 u |
| Formula | C15H24O |
| InChI | InChI=1S/C15H24O/c1-10(2)12-6-5-11(3)13-7-8-15(4,16)14(13)9-12/h9-10,13-14,16H,3,5-8H2,1-2,4H3/t13-,14-,15-/m1/s1 |
| InChIKey | BUPJOLXWQXEJSQ-RBSFLKMASA-N |
| Molecular Weight | 220.356 g/mol |
| SMILES | [C@]1(O)(CC[C@@]2(C(CCC(=C[C@@]12[H])C(C)C)=C)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.873339 |