SpectraBase Spectrum ID |
5GIuSEpoLz2 |
Name |
2,6-Pyridinedicarboxylic acid, 3-chlorobenzyl butyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H18ClNO4 |
InChI |
InChI=1S/C18H18ClNO4/c1-2-3-10-23-17(21)15-8-5-9-16(20-15)18(22)24-12-13-6-4-7-14(19)11-13/h4-9,11H,2-3,10,12H2,1H3 |
InChIKey |
HBMRMZQTLITKAW-UHFFFAOYSA-N |
Molecular Weight |
347.798 g/mol |
SMILES |
c1(nc(ccc1)C(OCCCC)=O)C(OCc1cccc(c1)Cl)=O |
SPLASH |
splash10-004i-2900000000-b5ca60d89c2e774a720c |
Source of Spectrum |
TIPS-2023-1011-0 |
Wiley ID |
1885717 |