SpectraBase Spectrum ID |
5wdJwRmqnuS |
Name |
(2-Hydroxyphenyl)-[4-[(E)-2-phenylethenyl]-4,5-dihydro-1H-pyrazol-3-yl]methanone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
292.121177761 u |
Formula |
C18H16N2O2 |
InChI |
InChI=1S/C18H16N2O2/c21-16-9-5-4-8-15(16)18(22)17-14(12-19-20-17)11-10-13-6-2-1-3-7-13/h1-11,14,19,21H,12H2/b11-10+ |
InChIKey |
RTRNILMOTJOTLY-ZHACJKMWSA-N |
SMILES |
C1(C(C=2C(O)=CC=CC2)=O)=NNCC1\C=C\C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961228 |