| SpectraBase Spectrum ID |
3vK6vdZAtrP |
| Name |
Glutaric 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 |
410.168915797 u |
| Formula |
C19H26N2O8 |
| InChI |
InChI=1S/C19H26N2O8/c1-3-4-5-6-10-28-18(22)8-7-9-19(23)29-13-15-11-16(20(24)25)12-17(14(15)2)21(26)27/h11-12H,3-10,13H2,1-2H3 |
| InChIKey |
UCBICRFWEROVCU-UHFFFAOYSA-N |
| Molecular Weight |
410.423 g/mol |
| SMILES |
C(OCC1=C(C)C(=CC(=C1)N(=O)=O)N(=O)=O)(=O)CCCC(OCCCCCC)=O |
