| SpectraBase Spectrum ID |
1AUE1E09Ii0 |
| Name |
(1-Cumyloxy-1-methyl-ethyl)benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
254.167065327 u |
| Formula |
C18H22O |
| InChI |
InChI=1S/C18H22O/c1-17(2,15-11-7-5-8-12-15)19-18(3,4)16-13-9-6-10-14-16/h5-14H,1-4H3 |
| InChIKey |
PZHXTCOVSRHUSS-UHFFFAOYSA-N |
| Molecular Weight |
254.373 g/mol |
| SMILES |
C(OC(C=1C=CC=CC1)(C)C)(C1=CC=CC=C1)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.927164 |
