| SpectraBase Spectrum ID |
8tcveMhynlN |
| Name |
Benzoic acid, 3-(3-methyl-1H-pyrazol-1-yl)-, methyl ester |
| CAS Registry Number |
100514-25-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12N2O2 |
| InChI |
InChI=1S/C12H12N2O2/c1-9-6-7-14(13-9)11-5-3-4-10(8-11)12(15)16-2/h3-8H,1-2H3 |
| InChIKey |
QLLPKGHGSKYMGB-UHFFFAOYSA-N |
| Molecular Weight |
216.240 g/mol |
| SMILES |
c1(n[n](cc1)-c1cc(C(=O)OC)ccc1)C |
| SPLASH |
splash10-00kr-0960000000-a7e9ef63dbc00d455306 |
| Source of Spectrum |
K-119-1638-0 |
| Synonyms |
Methyl 3-(3-methyl-1H-pyrazol-1-yl)benzoate |
| Wiley ID |
1215524 |
