| SpectraBase Spectrum ID |
JjNcIqaamsF |
| Name |
5,5'-Dicarboxy-3'-(2-chloroethyl)-4-(2-acetoxyethyl)-3,4'-dimethylpyrromethane |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H23ClN2O6 |
| InChI |
InChI=1S/C19H23ClN2O6/c1-9-13(5-7-28-11(3)23)17(19(26)27)21-14(9)8-15-12(4-6-20)10(2)16(22-15)18(24)25/h21-22H,4-8H2,1-3H3,(H,24,25)(H,26,27) |
| InChIKey |
IMVBQOTXCCGPTM-UHFFFAOYSA-N |
| Molecular Weight |
410.854 g/mol |
| SMILES |
[nH]1c(C(=O)O)c(c(CCCl)c1Cc1[nH]c(c(c1C)CCOC(=O)C)C(=O)O)C |
| SPLASH |
splash10-0006-9000000000-422002ece51ca917c656 |
| Source of Spectrum |
F-39-1854-0 |
| Synonyms |
5-({4-[2-(acetyloxy)ethyl]-5-carboxy-3-methyl-1H-pyrrol-2-yl}methyl)-4-(2-chloroethyl)-3-methyl-1H-pyrrole-2-carboxylic acid |
| Wiley ID |
1373536 |
