| SpectraBase Compound ID | 3CnY2tzqT4M |
|---|---|
| InChI | InChI=1S/C4H8BrNO/c1-2-3(5)4(6)7/h3H,2H2,1H3,(H2,6,7) |
| InChIKey | AKSLRYGHJVUELA-UHFFFAOYSA-N |
| Mol Weight | 166.02 g/mol |
| Molecular Formula | C4H8BrNO |
| Exact Mass | 164.978927 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8IZ6nJ5u7Qe |
|---|---|
| Name | Acecarbromal-A I |
| Classification | Sedative artifact |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass | 164.978926881 u |
| Formula | C4H8BrNO |
| InChI | InChI=1S/C4H8BrNO/c1-2-3(5)4(6)7/h3H,2H2,1H3,(H2,6,7) |
| InChIKey | AKSLRYGHJVUELA-UHFFFAOYSA-N |
| Ionization Type | Electron Ionization (EI) |
| Molecular Weight | 166.018 g/mol |
| Nominal Mass | 165 u |
| Quality | 992 |
| Retention Index | 1200 |
| SMILES | NC(C(CC)Br)=O |
| SPLASH | splash10-014l-9700000000-685ea922f0c5f276aba4 |
| Sample Comments | Structure uncertain |
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Synonyms | 2-bromobutanamide |
| Technique | GC/MS |
| Wiley ID | DD2024_011985 |