| SpectraBase Spectrum ID |
2m2cyQ8bB7A |
| Name |
4-Bromoheptane |
| CAS Registry Number |
998-93-6 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
178.035713483 u |
| Formula |
C7H15Br |
| InChI |
InChI=1S/C7H15Br/c1-3-5-7(8)6-4-2/h7H,3-6H2,1-2H3 |
| InChIKey |
BNUTXEKPXPZAIT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
179.101 g/mol |
| Nominal Mass |
178 u |
| Quality |
993 |
| Retention Index |
1071 |
| SMILES |
C(CCC)(CCC)Br |
| SPLASH |
splash10-0a4l-9000000000-dd8034018880335ad2fb |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000311 |
