| SpectraBase Spectrum ID |
9NPePL4cxOY |
| Name |
1H-Pyrazole-4,5-dicarboxylic acid, 1-[3-methoxy-1-(methoxycarbonyl)-3-oxopropyl]-3-(methylthio)-, dimethyl ester |
| CAS Registry Number |
79489-91-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18N2O8S |
| InChI |
InChI=1S/C14H18N2O8S/c1-21-8(17)6-7(12(18)22-2)16-10(14(20)24-4)9(13(19)23-3)11(15-16)25-5/h7H,6H2,1-5H3 |
| InChIKey |
BNZKLKXFMHXQRC-UHFFFAOYSA-N |
| Molecular Weight |
374.364 g/mol |
| SMILES |
c1([n](nc(c1C(=O)OC)SC)C(CC(=O)OC)C(=O)OC)C(=O)OC |
| SPLASH |
splash10-007o-1039000000-4ef92849e27d2cc4a11b |
| Source of Spectrum |
K-114-2463-0 |
| Synonyms |
Dimethyl 1-[3-methoxy-1-(methoxycarbonyl)-3-oxopropyl]-3-(methylsulfanyl)-1H-pyrazole-4,5-dicarboxylate
Dimethylester of 1-[1,2-bis(methyoxycarbonyl)ethyl]-3-(methylthio)-4,5-pyrazoldicarboxylic acid |
| Wiley ID |
1356331 |
![1H-Pyrazole-4,5-dicarboxylic acid, 1-[3-methoxy-1-(methoxycarbonyl)-3-oxopropyl]-3-(methylthio)-, dimethyl ester](/api/spectrum/9NPePL4cxOY/structure.png?h=300&w=458 "1H-Pyrazole-4,5-dicarboxylic acid, 1-[3-methoxy-1-(methoxycarbonyl)-3-oxopropyl]-3-(methylthio)-, dimethyl ester")
