SpectraBase Spectrum ID |
F459yYBQo6a |
Name |
Benzene, 1-(3,5-diethoxy-6-methyl-1-cyclohexen-1-yl)-4-methoxy- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
290.188194694 u |
Formula |
C18H26O3 |
InChI |
InChI=1S/C18H26O3/c1-5-20-16-11-17(13(3)18(12-16)21-6-2)14-7-9-15(19-4)10-8-14/h7-11,13,16,18H,5-6,12H2,1-4H3 |
InChIKey |
NIHUAWDPCPDRIR-UHFFFAOYSA-N |
Molecular Weight |
290.403 g/mol |
SMILES |
C=1(C(C(OCC)CC(C1)OCC)C)C=1C=CC(=CC1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922386 |