| SpectraBase Spectrum ID |
AVQ4NqnidyH |
| Name |
(E)-1-Benzylidene-1H-indene-3-carbaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
232.088815005 u |
| Formula |
C17H12O |
| InChI |
InChI=1S/C17H12O/c18-12-15-11-14(10-13-6-2-1-3-7-13)16-8-4-5-9-17(15)16/h1-12H/b14-10+ |
| InChIKey |
WDPAYOSBWLMUEX-GXDHUFHOSA-N |
| Molecular Weight |
232.282 g/mol |
| SMILES |
C1=C(C=CC=C1)\C=C/1C=C(C2=C1C=CC=C2)C=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929273 |
