| SpectraBase Spectrum ID |
8IR1gUOo6iG |
| Name |
N-(Diethylaminoethyl)-2,4-dinitroaniline |
| CAS Registry Number |
56223-91-7 |
| Classification |
Pharmaceutical drug derivative |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
282.132805072 u |
| Formula |
C12H18N4O4 |
| InChI |
InChI=1S/C12H18N4O4/c1-3-14(4-2)8-7-13-11-6-5-10(15(17)18)9-12(11)16(19)20/h5-6,9,13H,3-4,7-8H2,1-2H3 |
| InChIKey |
HGZRREOJHASMOE-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
282.300 g/mol |
| Nominal Mass |
282 u |
| Quality |
996 |
| Retention Index |
2321 |
| SMILES |
C=1(C(NCCN(CC)CC)=CC=C(C1)[N+](=O)[O-])[N+](=O)[O-] |
| SPLASH |
splash10-000i-9000000000-e36d160d481900ed11a9 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Etonitazen Intermediate
N1-(2,4-dinitrophenyl)-N2,N2-diethylethane-1,2-diamine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002608 |
