| SpectraBase Spectrum ID |
AeSLthGuheS |
| Name |
Glutaric acid, decyl 4-methyl-3-nitrobenzyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
421.246437845 u |
| Formula |
C23H35NO6 |
| InChI |
InChI=1S/C23H35NO6/c1-3-4-5-6-7-8-9-10-16-29-22(25)12-11-13-23(26)30-18-20-15-14-19(2)21(17-20)24(27)28/h14-15,17H,3-13,16,18H2,1-2H3 |
| InChIKey |
VYIJRRGANOZPAW-UHFFFAOYSA-N |
| Molecular Weight |
421.534 g/mol |
| SMILES |
C(OCC1=CC(=C(C=C1)C)N(=O)=O)(=O)CCCC(OCCCCCCCCCC)=O |
