| SpectraBase Spectrum ID |
Gf6yZZwLmdu |
| Name |
Succinic acid, 3,5-dinitro-2-methylbenzyl hexyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
396.153265733 u |
| Formula |
C18H24N2O8 |
| InChI |
InChI=1S/C18H24N2O8/c1-3-4-5-6-9-27-17(21)7-8-18(22)28-12-14-10-15(19(23)24)11-16(13(14)2)20(25)26/h10-11H,3-9,12H2,1-2H3 |
| InChIKey |
PDMRAFARUAXFCK-UHFFFAOYSA-N |
| Molecular Weight |
396.396 g/mol |
| SMILES |
C(CCC(OCC=1C(C)=C(C=C(N(=O)=O)C1)N(=O)=O)=O)(OCCCCCC)=O |
