| SpectraBase Spectrum ID |
6VTufW3w9iU |
| Name |
1H-Pyrrole-3,4-dicarboxylic acid, 2-(5-chloro-2-methoxyphenyl)-, diethyl ester |
| Alternate Name(s) |
Diethyl 2-(2-methoxyphenyl)pyrrole-chloro-3,4-dicarboxylate
diethyl 2-(5-chloro-2-methoxyphenyl)-1H-pyrrole-3,4-dicarboxylate |
| CAS Registry Number |
69640-15-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H18ClNO5 |
| InChI |
InChI=1S/C17H18ClNO5/c1-4-23-16(20)12-9-19-15(14(12)17(21)24-5-2)11-8-10(18)6-7-13(11)22-3/h6-9,19H,4-5H2,1-3H3 |
| InChIKey |
JTNHXMPOHXDQLT-UHFFFAOYSA-N |
| Molecular Weight |
351.786 g/mol |
| SMILES |
[nH]1cc(c(c1-c1c(ccc(c1)Cl)OC)C(=O)OCC)C(=O)OCC |
| SPLASH |
splash10-0udi-0009000000-cd0aea0978cf53c8cac7 |
| Source of Spectrum |
KC-1978-1592-0 |
| Wiley ID |
1342502 |
