| SpectraBase Spectrum ID |
KvgWLBvkwUj |
| Name |
1H-Pyrrole-2-carboxylic acid, 5,5'-(2-nitro-1,3-propanediyl)bis[3,4-dimethyl-, bis(1,1-dimethylethyl) ester |
| CAS Registry Number |
114090-69-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H37N3O6 |
| InChI |
InChI=1S/C25H37N3O6/c1-13-15(3)20(22(29)33-24(5,6)7)26-18(13)11-17(28(31)32)12-19-14(2)16(4)21(27-19)23(30)34-25(8,9)10/h17,26-27H,11-12H2,1-10H3 |
| InChIKey |
DSOISSYRSLMKLR-UHFFFAOYSA-N |
| Molecular Weight |
475.586 g/mol |
| SMILES |
[nH]1c(c(c(c1CC(Cc1c(c(c([nH]1)C(OC(C)(C)C)=O)C)C)N(=O)=O)C)C)C(OC(C)(C)C)=O |
| SPLASH |
splash10-004i-0910100000-980c35361ed656fce758 |
| Source of Spectrum |
KC-1987-2042-40 |
| Synonyms |
1,3-bis(3,4-dimethyl-5-t-butoxycarbonylpyrrol-2-yl)-2-nitropropane
tert-Butyl 5-{3-[5-(tert-butoxycarbonyl)-3,4-dimethyl-1H-pyrrol-2-yl]-2-nitropropyl}-3,4-dimethyl-1H-pyrrole-2-carboxylate |
| Wiley ID |
1394109 |
