SpectraBase Spectrum ID |
BKNw9KOePDC |
Name |
Chroman-4-one, 2,3-dehydro-6-ethyl-7-methoxy-2-methyl-3-phenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
294.125594437 u |
Formula |
C19H18O3 |
InChI |
InChI=1S/C19H18O3/c1-4-13-10-15-17(11-16(13)21-3)22-12(2)18(19(15)20)14-8-6-5-7-9-14/h5-11H,4H2,1-3H3 |
InChIKey |
AGMFDOOWGCLDQI-UHFFFAOYSA-N |
SMILES |
C1(C(=C(C)OC2=C1C=C(CC)C(=C2)OC)C1=CC=CC=C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872139 |