SpectraBase Spectrum ID |
AzeZ6wctC79 |
Name |
1-Pyrazolidinecarboxylic acid, 4-methyl-2-[(2-nitrophenyl)methyl]-5-oxo-, 1,1-dimethylethyl ester, (.+-.)- |
CAS Registry Number |
130064-98-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H21N3O5 |
InChI |
InChI=1S/C16H21N3O5/c1-11-9-17(10-12-7-5-6-8-13(12)19(22)23)18(14(11)20)15(21)24-16(2,3)4/h5-8,11H,9-10H2,1-4H3 |
InChIKey |
WDOIARQOZUXVGP-UHFFFAOYSA-N |
Molecular Weight |
335.360 g/mol |
SMILES |
C1N(N(C(C1C)=O)C(OC(C)(C)C)=O)Cc1c(N(=O)=O)cccc1 |
SPLASH |
splash10-01c0-0490000000-36fc362f12f6db63053c |
Source of Spectrum |
J-55-6043-28 |
Synonyms |
2-(t-butoxycarbonyl)-4-methyl-1-(o-nitrobenzyl)pyrazolidin-3-one
tert-Butyl 4-methyl-2-(2-nitrobenzyl)-5-oxo-1-pyrazolidinecarboxylate |
Wiley ID |
1331589 |