| SpectraBase Compound ID | TMsuwZ5FxK |
|---|---|
| InChI | InChI=1S/C25H40O2/c1-18(2)9-7-14-24(5)15-8-16-25(6)21(20(4)11-13-22(24)25)12-10-19(3)17-23(26)27/h9,17,22H,7-8,10-16H2,1-6H3,(H,26,27)/b19-17+/t22?,24-,25-/m1/s1 |
| InChIKey | VMXBEUNFNFIWLY-HKAUEAINSA-N |
| Mol Weight | 372.6 g/mol |
| Molecular Formula | C25H40O2 |
| Exact Mass | 372.302831 g/mol |
Vapor Phase (Gas) Infrared Spectrum
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5WIk9VfHDxK |
|---|---|
| Name | (+)-dysideapalaunic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 372.302830526 u |
| Formula | C25H40O2 |
| InChI | InChI=1S/C25H40O2/c1-18(2)9-7-14-24(5)15-8-16-25(6)21(20(4)11-13-22(24)25)12-10-19(3)17-23(26)27/h9,17,22H,7-8,10-16H2,1-6H3,(H,26,27)/b19-17+/t22?,24-,25-/m1/s1 |
| InChIKey | VMXBEUNFNFIWLY-HKAUEAINSA-N |
| Molecular Weight | 372.593 g/mol |
| SMILES | [C@@]12(C(=C(C)CCC2[C@@](CCC=C(C)C)(C)CCC1)CC\C(=C\C(=O)O)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94901 |