SpectraBase Spectrum ID |
DVNoPgQo7uD |
Name |
5-(Hydroxy)-5-(diphenyl)pent-2-en-1-al |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
252.115029753 u |
Formula |
C17H16O2 |
InChI |
InChI=1S/C17H16O2/c18-14-8-7-13-17(19,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-12,14,19H,13H2/b8-7+ |
InChIKey |
SAZZZPPYDQTFGP-BQYQJAHWSA-N |
Molecular Weight |
252.313 g/mol |
SMILES |
C(C1=CC=CC=C1)(C1=CC=CC=C1)(O)C\C=C\C=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97584 |