SpectraBase Spectrum ID |
EDqC3ynY0xP |
Name |
3-Pyrazolidineacetic acid, 4,5-dicyano-3-(methoxycarbonyl)-2-methyl-, methyl ester, (3.alpha.,4.alpha.,5.beta.)-(.+-.)- |
CAS Registry Number |
70954-86-8 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H14N4O4 |
InChI |
InChI=1S/C11H14N4O4/c1-15-11(10(17)19-3,4-9(16)18-2)7(5-12)8(6-13)14-15/h7-8,14H,4H2,1-3H3/t7-,8-,11-/m1/s1 |
InChIKey |
RYGRETXMCZHCQV-SOCHQFKDSA-N |
Molecular Weight |
266.257 g/mol |
SMILES |
N1[C@@]([C@]([C@](N1C)(CC(=O)OC)C(=O)OC)(C#N)[H])(C#N)[H] |
SPLASH |
splash10-0aou-0390000000-9806ba9b1133f93f18cb |
Source of Spectrum |
K-112-1729-0 |
Synonyms |
Methyl (3R,4R,5S)-4,5-dicyano-3-(2-methoxy-2-oxoethyl)-2-methyl-3-pyrazolidinecarboxylate
Methyl ester of(3S,4R,5S,3R,4S,5R)-3,4-dicyano-5-(methoxycarbonylmethyl)-1-methyl-5-pyrazolidincarboxylic acid |
Wiley ID |
1269485 |