| SpectraBase Spectrum ID |
8HM14kanMkC |
| Name |
2-Bromohexane |
| CAS Registry Number |
3377-86-4 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
164.020063419 u |
| Formula |
C6H13Br |
| InChI |
InChI=1S/C6H13Br/c1-3-4-5-6(2)7/h6H,3-5H2,1-2H3 |
| InChIKey |
NEBYCXAKZCQWAW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
165.074 g/mol |
| Nominal Mass |
164 u |
| Quality |
998 |
| Retention Index |
927 |
| SMILES |
C(CCCC)(Br)C |
| SPLASH |
splash10-000f-9000000000-5d0e771f59cfd87769da |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Hexane,2-bromo |
| Technique |
GC/MS |
| Wiley ID |
DD2024_023825 |
