| SpectraBase Spectrum ID |
JbMGVvnVmuM |
| Name |
Methyl 4-[hexyl(methyl)amino]-3-nitro-benzoate |
| Appearance |
Orange oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H22N2O4 |
| InChI |
InChI=1S/C15H22N2O4/c1-4-5-6-7-10-16(2)13-9-8-12(15(18)21-3)11-14(13)17(19)20/h8-9,11H,4-7,10H2,1-3H3 |
| InChIKey |
WKAABCASIWWUSW-UHFFFAOYSA-N |
| Instrument Name |
Varian GCMS Saturn 2100 T |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201812068 |
| Molecular Weight |
294.351 g/mol |
| Reported Formula |
C15H23N2O4 |
| SMILES |
c1c(c(ccc1C(=O)OC)N(CCCCCC)C)[N+]([O-])=O |
| SPLASH |
splash10-00di-0190000000-298c05dd8f771848c4e4 |
| Source of Spectrum |
ACI-58-SM23-3fn |
| Wiley ID |
1840452 |
![Methyl 4-[hexyl(methyl)amino]-3-nitro-benzoate](/api/spectrum/JbMGVvnVmuM/structure.png?h=300&w=458 "Methyl 4-[hexyl(methyl)amino]-3-nitro-benzoate")
