SpectraBase Spectrum ID |
7POVyKjJVsl |
Name |
3-Oxapentane, 2,2,5-triphenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
302.167065327 u |
Formula |
C22H22O |
InChI |
InChI=1S/C22H22O/c1-22(20-13-7-3-8-14-20,21-15-9-4-10-16-21)23-18-17-19-11-5-2-6-12-19/h2-16H,17-18H2,1H3 |
InChIKey |
LPHLURRDJLTONV-UHFFFAOYSA-N |
Molecular Weight |
302.417 g/mol |
SMILES |
C1=CC=CC(=C1)C(C1=CC=CC=C1)(C)OCCC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950033 |