| SpectraBase Spectrum ID |
4EYoKLg8P92 |
| Name |
5,6-Epoxy-4,4-diphenyl-6-methoxy-2-cyclohexen-1-one .alpha.-keto ketal |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.151809184 u |
| Formula |
C21H22O4 |
| InChI |
InChI=1S/C21H22O4/c1-3-25-21(24-2)18(22)14-15-20(19(21)23,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-15,19,23H,3H2,1-2H3/t19-,21-/m0/s1 |
| InChIKey |
AQLNXAFMUYOGFD-FPOVZHCZSA-N |
| Molecular Weight |
338.403 g/mol |
| SMILES |
[C@]1([C@](C(C=2C=CC=CC2)(C2=CC=CC=C2)C=CC1=O)(O)[H])(OC)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.83231 |
