SpectraBase Spectrum ID |
DnQnJ8u32tg |
Name |
7-[( p-Chlorobenzyl)oxy]-2,2,5-trimethylchromene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
314.107357550 u |
Formula |
C19H19ClO2 |
InChI |
InChI=1S/C19H19ClO2/c1-13-10-16(21-12-14-4-6-15(20)7-5-14)11-18-17(13)8-9-19(2,3)22-18/h4-11H,12H2,1-3H3 |
InChIKey |
FISWGBOLIUUBHL-UHFFFAOYSA-N |
SMILES |
C1(C=CC=2C(=CC(=CC2O1)OCC=1C=CC(=CC1)Cl)C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.81566 |