| SpectraBase Spectrum ID |
KkVLCk5EM4p |
| Name |
(E)-(2-Benzylidenecyclopropyl)(phenyl)methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
234.104465070 u |
| Formula |
C17H14O |
| InChI |
InChI=1S/C17H14O/c18-17(14-9-5-2-6-10-14)16-12-15(16)11-13-7-3-1-4-8-13/h1-11,16H,12H2/b15-11+ |
| InChIKey |
JATLJJSMYVHFEF-RVDMUPIBSA-N |
| Molecular Weight |
234.298 g/mol |
| SMILES |
C1(\C(C1)=C\C=1C=CC=CC1)C(=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97169 |
