SpectraBase Spectrum ID |
IUWgLR8F07Z |
Name |
1H-Pyrrole-2-carboxylic acid, 5-(5-hydroxy-2-methyl-2-nitro-3-pentenyl)-3,4-dimethyl-, 1,1-dimethylethyl ester, (Z)-(.+-.)- |
CAS Registry Number |
114090-56-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H26N2O5 |
InChI |
InChI=1S/C17H26N2O5/c1-11-12(2)14(15(21)24-16(3,4)5)18-13(11)10-17(6,19(22)23)8-7-9-20/h7-8,18,20H,9-10H2,1-6H3/b8-7- |
InChIKey |
PSABZTHAIUNHBH-FPLPWBNLSA-N |
Molecular Weight |
338.404 g/mol |
SMILES |
[nH]1c(c(c(c1CC(\C=C/CO)(N(=O)=O)C)C)C)C(OC(C)(C)C)=O |
SPLASH |
splash10-0udi-2900000000-50cbcfb0bd8926a4ddc5 |
Source of Spectrum |
KC-1987-2040-22 |
Synonyms |
t-Butyl 5-[(Z)-5-hydroxy-2-methyl-2-nitropent-3-enyl]-3,4-dimethylpyrrole-2-carboxylate
tert-Butyl 5-[(3Z)-5-hydroxy-2-methyl-2-nitro-3-pentenyl]-3,4-dimethyl-1H-pyrrole-2-carboxylate |
Wiley ID |
1333611 |