| SpectraBase Spectrum ID |
5bwq7aEvmGz |
| Name |
Methyl 4,5-dihydro-5-hydroxy-5-(4-nitrophenyl)-3-methylpyrazole-1-carboxylate |
| Alternate Name(s) |
methyl 5-hydroxy-3-methyl-5-(4-nitrophenyl)-4,5-dihydro-1H-pyrazole-1-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13N3O5 |
| InChI |
InChI=1S/C12H13N3O5/c1-8-7-12(17,14(13-8)11(16)20-2)9-3-5-10(6-4-9)15(18)19/h3-6,17H,7H2,1-2H3 |
| InChIKey |
DODDRGBYTITQPV-UHFFFAOYSA-N |
| Molecular Weight |
279.252 g/mol |
| SMILES |
OC1(N(N=C(C)C1)C(=O)OC)c1ccc(N(=O)=O)cc1 |
| SPLASH |
splash10-03di-0090000000-ea8c3f059c1cc7d264c8 |
| Source of Spectrum |
H1-51-2681-10 |
| Wiley ID |
817507 |
