| SpectraBase Spectrum ID |
4vKJPYUWDvL |
| Name |
2-Hydroxy-7-methoxy-5-methyl-1-naphthalenecarboxylic acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
246.089208927 u |
| Formula |
C14H14O4 |
| InChI |
InChI=1S/C14H14O4/c1-8-6-9(17-2)7-11-10(8)4-5-12(15)13(11)14(16)18-3/h4-7,15H,1-3H3 |
| InChIKey |
XYPWHNVUVDLREK-UHFFFAOYSA-N |
| Molecular Weight |
246.262 g/mol |
| SMILES |
C1(=C2C(C(C)=CC(=C2)OC)=CC=C1O)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.817311 |
