SpectraBase Spectrum ID |
4fIpQsGVDUh |
Name |
2,6-Pyridinedicarboxylic acid, 3,5-dinitro-4-methylbenzyl propyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H17N3O8 |
InChI |
InChI=1S/C18H17N3O8/c1-3-7-28-17(22)13-5-4-6-14(19-13)18(23)29-10-12-8-15(20(24)25)11(2)16(9-12)21(26)27/h4-6,8-9H,3,7,10H2,1-2H3 |
InChIKey |
NJKQMFVZIBSYSB-UHFFFAOYSA-N |
Molecular Weight |
403.347 g/mol |
SMILES |
C(OC(c1nc(ccc1)C(OCc1cc(c(c(c1)N(=O)=O)C)N(=O)=O)=O)=O)CC |
SPLASH |
splash10-014i-3900000000-995cec742c290c7be2d0 |
Source of Spectrum |
TIPS-2023-962-0 |
Wiley ID |
1885668 |