| SpectraBase Compound ID | 69FmpUfTPip |
|---|---|
| InChI | InChI=1S/C24H38O4/c1-15(27-16(2)25)23(6)13-18-10-11-19-20(9-8-12-22(19,4)5)24(18,7)21(14-23)28-17(3)26/h11,15,18,20-21H,8-10,12-14H2,1-7H3/t15-,18-,20-,21+,23+,24-/m0/s1 |
| InChIKey | UHZNWJOMIVJSLT-JSAUJTTOSA-N |
| Mol Weight | 390.6 g/mol |
| Molecular Formula | C24H38O4 |
| Exact Mass | 390.27701 g/mol |
| SpectraBase Spectrum ID | KjlidrR1aOO |
|---|---|
| Name | (15R)-11.beta.,15-Diacetoxy-ros-5-ene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 390.277009700 u |
| Formula | C24H38O4 |
| InChI | InChI=1S/C24H38O4/c1-15(27-16(2)25)23(6)13-18-10-11-19-20(9-8-12-22(19,4)5)24(18,7)21(14-23)28-17(3)26/h11,15,18,20-21H,8-10,12-14H2,1-7H3/t15-,18-,20-,21+,23+,24-/m0/s1 |
| InChIKey | UHZNWJOMIVJSLT-JSAUJTTOSA-N |
| Molecular Weight | 390.564 g/mol |
| SMILES | [C@]12([C@@]3(C(C(C)(C)CCC3)=CC[C@]1(C[C@]([C@@](OC(=O)C)(C)[H])(C)C[C@]2(OC(=O)C)[H])[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.980635 |