| SpectraBase Spectrum ID |
Aa6sGLGcnMV |
| Name |
4H-1-Benzopyran-4-one, 2-methyl-3-(phenylmethyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
250.099379689 u |
| Formula |
C17H14O2 |
| InChI |
InChI=1S/C17H14O2/c1-12-15(11-13-7-3-2-4-8-13)17(18)14-9-5-6-10-16(14)19-12/h2-10H,11H2,1H3 |
| InChIKey |
WTPHNPYSUQUJEI-UHFFFAOYSA-N |
| Molecular Weight |
250.297 g/mol |
| SMILES |
C=1(C(C=2C=CC=CC2OC1C)=O)CC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933558 |
