SpectraBase Spectrum ID |
EG5gfBguQke |
Name |
2-Propenal, 3-(4-chlorophenyl)-2-methyl-; p-chloro-alpha-methylcinnamaldehyde |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
180.034192609 u |
Formula |
C10H9ClO |
InChI |
InChI=1S/C10H9ClO/c1-8(7-12)6-9-2-4-10(11)5-3-9/h2-7H,1H3/b8-6+ |
InChIKey |
IQJAMSUNWQAPAF-SOFGYWHQSA-N |
Molecular Weight |
180.634 g/mol |
SMILES |
C1(=CC=C(C=C1)Cl)\C=C\(C=O)C |
Spectrum/Structure Validation Score (Raman) |
0.719506 |