| SpectraBase Spectrum ID |
5AYehITDXfJ |
| Name |
(4R,5S)-4-Methyl-5-phenyl-5-(phenylmethyl)-1-cyclopent-2-enone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
262.135765199 u |
| Formula |
C19H18O |
| InChI |
InChI=1S/C19H18O/c1-15-12-13-18(20)19(15,17-10-6-3-7-11-17)14-16-8-4-2-5-9-16/h2-13,15H,14H2,1H3/t15-,19+/m1/s1 |
| InChIKey |
FVZBFFKBVMPWGG-BEFAXECRSA-N |
| Molecular Weight |
262.352 g/mol |
| SMILES |
[C@@]1(C(C=C[C@]1(C)[H])=O)(CC=1C=CC=CC1)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.87372 |
