SpectraBase Spectrum ID |
CoK35aCTnHZ |
Name |
6-{[((4'-Nitrobenzyl)(4''-nitrophenoxy)phosphoryl]oxy}hexanoic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H21N2O9P |
InChI |
InChI=1S/C19H21N2O9P/c22-19(23)4-2-1-3-13-29-31(28,14-15-5-7-16(8-6-15)20(24)25)30-18-11-9-17(10-12-18)21(26)27/h5-12H,1-4,13-14H2,(H,22,23) |
InChIKey |
XWFOGHTVRZIGLF-UHFFFAOYSA-N |
Molecular Weight |
452.356 g/mol |
SMILES |
OC(CCCCCOP(Oc1ccc(N(=O)=O)cc1)(=O)Cc1ccc(N(=O)=O)cc1)=O |
SPLASH |
splash10-00kr-9606000000-e5764321425c1fb9d888 |
Source of Spectrum |
I-78-654-9 |
Wiley ID |
812600 |