SpectraBase Spectrum ID |
16JtlGhDgFT |
Name |
Ethanone, 2-(3-cyclopenten-1-yl)-1-phenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
186.104465070 u |
Formula |
C13H14O |
InChI |
InChI=1S/C13H14O/c14-13(10-11-6-4-5-7-11)12-8-2-1-3-9-12/h1-5,8-9,11H,6-7,10H2 |
InChIKey |
BPLQNYZWGDWECB-UHFFFAOYSA-N |
Molecular Weight |
186.254 g/mol |
SMILES |
C(CC1CC=CC1)(=O)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937054 |