| SpectraBase Spectrum ID |
9u2k76AvlNI |
| Name |
5-(2-Hydroxyphenyl)-1,3-dimethyl-1H-pyrazol-4-carboxylic acid methyl ester |
| Alternate Name(s) |
methyl 5-(2-hydroxyphenyl)-1,3-dimethyl-1H-pyrazole-4-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14N2O3 |
| InChI |
InChI=1S/C13H14N2O3/c1-8-11(13(17)18-3)12(15(2)14-8)9-6-4-5-7-10(9)16/h4-7,16H,1-3H3 |
| InChIKey |
JMXJXYTXFFOOSC-UHFFFAOYSA-N |
| Molecular Weight |
246.266 g/mol |
| SMILES |
Oc1c(-c2[n](nc(c2C(=O)OC)C)C)cccc1 |
| SPLASH |
splash10-0002-0090000000-9a1e313f6781668de02f |
| Source of Spectrum |
KC-60-1756-4 |
| Wiley ID |
1583511 |
