| SpectraBase Spectrum ID |
24I9nqRsPNw |
| Name |
Avocadene acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.261359635 u |
| Formula |
C19H36O4 |
| InChI |
InChI=1S/C19H36O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18(21)15-19(22)16-23-17(2)20/h3,18-19,21-22H,1,4-16H2,2H3/t18-,19-/m0/s1 |
| InChIKey |
NLBYRERHXBTBBR-OALUTQOASA-N |
| Molecular Weight |
328.493 g/mol |
| SMILES |
C(C)(=O)OC[C@](C[C@](CCCCCCCCCCCC=C)(O)[H])(O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.825293 |
