SpectraBase Spectrum ID |
82oT4GNQJcp |
Name |
2H-1-Benzopyran-2-one, 7-hydroxy-3,4-dimethyl-; 3,4-dimethyl-7-hydroxycoumarin; 7-hydroxy-3,4-dimethylcoumarin; coumarin, 7-hydroxy-3,4-dimethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
190.062994179 u |
Formula |
C11H10O3 |
InChI |
InChI=1S/C11H10O3/c1-6-7(2)11(13)14-10-5-8(12)3-4-9(6)10/h3-5,12H,1-2H3 |
InChIKey |
QEEXKPYVMOIPKR-UHFFFAOYSA-N |
Molecular Weight |
190.198 g/mol |
SMILES |
OC=1C=CC=2C(=C(C(=O)OC2C1)C)C |
Spectrum/Structure Validation Score (Raman) |
0.992048 |