| SpectraBase Spectrum ID |
5qowkvbbXC6 |
| Name |
2H-2-Pyrindine-3,4-dicarboxylic acid, 5-acetyl-1-cyano-6-methyl-, dimethyl ester |
| CAS Registry Number |
84662-36-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H14N2O5 |
| InChI |
InChI=1S/C16H14N2O5/c1-7-5-9-10(6-17)18-14(16(21)23-4)13(15(20)22-3)12(9)11(7)8(2)19/h5,18H,1-4H3 |
| InChIKey |
BOWKQVNQLRGBDV-UHFFFAOYSA-N |
| Molecular Weight |
314.297 g/mol |
| SMILES |
N1C(=C2C(C(=C1C(=O)OC)C(=O)OC)=C(C(=C2)C)C(=O)C)C#N |
| SPLASH |
splash10-01ot-0907000000-14515dec35d7c04e56b7 |
| Source of Spectrum |
K-116-102-0 |
| Synonyms |
dimethyl 5-acetyl-1-cyano-6-methyl-2H-cyclopenta[c]pyridine-3,4-dicarboxylate
Dimethyl ester of 5-acetyl-1-cyano-6-methyl-2H-cyclopenta[c]pyridin-3,4-dicarboxylic acid |
| Wiley ID |
1314859 |
