| SpectraBase Spectrum ID |
JI1fnIZUTBY |
| Name |
Bromvaletone |
| CAS Registry Number |
496-67-3 |
| Classification |
Pharmaceutical drug, hypnotic sedative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
222.000390600 u |
| Formula |
C6H11BrN2O2 |
| InChI |
InChI=1S/C6H11BrN2O2/c1-3(2)4(7)5(10)9-6(8)11/h3-4H,1-2H3,(H3,8,9,10,11) |
| InChIKey |
CMCCHHWTTBEZNM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
223.070 g/mol |
| Nominal Mass |
222 u |
| Quality |
995 |
| Retention Index |
1546 |
| SMILES |
NC(NC(C(C(C)C)Br)=O)=O |
| SPLASH |
splash10-000x-9600000000-04cd0a3d7f1dc918e65f |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Bromisoval
alpha-Bromoisovalerianylurea
2-Bromo-N-carbamoyl-3-methylbutanamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000337 |
