| SpectraBase Spectrum ID |
8ruBb9fQhwZ |
| Name |
2-Bromooctane |
| CAS Registry Number |
557-35-7 |
| Classification |
Alkylating agent |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
192.051363547 u |
| Formula |
C8H17Br |
| InChI |
InChI=1S/C8H17Br/c1-3-4-5-6-7-8(2)9/h8H,3-7H2,1-2H3 |
| InChIKey |
FTJHYGJLHCGQHQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
193.128 g/mol |
| Nominal Mass |
192 u |
| Quality |
994 |
| Retention Index |
1171 |
| SMILES |
C(CCCCCC)(Br)C |
| SPLASH |
splash10-0abc-9000000000-5877b1814a049d266fa0 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000323 |
