SpectraBase Spectrum ID |
4cOaHvNRM0c |
Name |
Succinic acid, decyl 2-nitrobenzyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
393.215137716 u |
Formula |
C21H31NO6 |
InChI |
InChI=1S/C21H31NO6/c1-2-3-4-5-6-7-8-11-16-27-20(23)14-15-21(24)28-17-18-12-9-10-13-19(18)22(25)26/h9-10,12-13H,2-8,11,14-17H2,1H3 |
InChIKey |
LZSRXCZTWAMWRQ-UHFFFAOYSA-N |
Molecular Weight |
393.480 g/mol |
SMILES |
C1=CC=C(C(=C1)N(=O)=O)COC(=O)CCC(OCCCCCCCCCC)=O |