| SpectraBase Spectrum ID |
1Onlb1woQC5 |
| Name |
Glutaric acid, decyl 3-methyl-2-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/c1-3-4-5-6-7-8-9-10-17-29-21(25)15-12-16-22(26)30-18-20-14-11-13-19(2)23(20)24(27)28/h11,13-14H,3-10,12,15-18H2,1-2H3 |
| InChIKey |
HZBLBCPNIWVHOS-UHFFFAOYSA-N |
| Molecular Weight |
421.534 g/mol |
| SMILES |
C(OCC1=C(C(C)=CC=C1)N(=O)=O)(=O)CCCC(OCCCCCCCCCC)=O |
