| SpectraBase Spectrum ID |
KE8F0DAI6yM |
| Name |
(E)-11-Phenyl-10-undecenoic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
260.177630011 u |
| Formula |
C17H24O2 |
| InChI |
InChI=1S/C17H24O2/c18-17(19)15-11-6-4-2-1-3-5-8-12-16-13-9-7-10-14-16/h7-10,12-14H,1-6,11,15H2,(H,18,19)/b12-8+ |
| InChIKey |
HAUAQZUNRWFWJE-XYOKQWHBSA-N |
| Molecular Weight |
260.377 g/mol |
| SMILES |
C(=O)(O)CCCCCCCC\C=C\C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977454 |
