SpectraBase Spectrum ID |
KJoe1qdGjNc |
Name |
Glutaric acid, 3-nitro-4-methoxybenzyl tridecyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
479.288302657 u |
Formula |
C26H41NO7 |
InChI |
InChI=1S/C26H41NO7/c1-3-4-5-6-7-8-9-10-11-12-13-19-33-25(28)15-14-16-26(29)34-21-22-17-18-24(32-2)23(20-22)27(30)31/h17-18,20H,3-16,19,21H2,1-2H3 |
InChIKey |
MERKDBBHBTYQTR-UHFFFAOYSA-N |
Molecular Weight |
479.614 g/mol |
SMILES |
C(OCC1=CC=C(C(=C1)N(=O)=O)OC)(=O)CCCC(OCCCCCCCCCCCCC)=O |