SpectraBase Spectrum ID |
KQBsNejJO73 |
Name |
2-[2-Chloro-1-isopropyl-4-(ethoxycarbonyl)-5-methyl-1H-pyrrol-3-yl]acetic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H18ClNO4 |
InChI |
InChI=1S/C13H18ClNO4/c1-5-19-13(18)11-8(4)15(7(2)3)12(14)9(11)6-10(16)17/h7H,5-6H2,1-4H3,(H,16,17) |
InChIKey |
XVBBIOLEIGYPDC-UHFFFAOYSA-N |
Molecular Weight |
287.743 g/mol |
SMILES |
OC(Cc1c(Cl)[n](c(c1C(=O)OCC)C)C(C)C)=O |
SPLASH |
splash10-0006-9660000000-d9d80dec7d8b725b3bce |
Source of Spectrum |
F-65-1706-3h |
Wiley ID |
1681772 |