| SpectraBase Spectrum ID |
Fs2nSijofDN |
| Name |
Glutaric acid, hexyl 3-nitro-4-methoxybenzyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
381.178752206 u |
| Formula |
C19H27NO7 |
| InChI |
InChI=1S/C19H27NO7/c1-3-4-5-6-12-26-18(21)8-7-9-19(22)27-14-15-10-11-17(25-2)16(13-15)20(23)24/h10-11,13H,3-9,12,14H2,1-2H3 |
| InChIKey |
VACPZODGRBNLEY-UHFFFAOYSA-N |
| Molecular Weight |
381.425 g/mol |
| SMILES |
C(OCC1=CC=C(C(=C1)N(=O)=O)OC)(=O)CCCC(OCCCCCC)=O |
