| SpectraBase Spectrum ID |
DmgMoWA3BNw |
| Name |
Iodooctane |
| CAS Registry Number |
629-27-6 |
| Classification |
Alkylating agent |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
240.037495547 u |
| Formula |
C8H17I |
| InChI |
InChI=1S/C8H17I/c1-2-3-4-5-6-7-8-9/h2-8H2,1H3 |
| InChIKey |
UWLHSHAHTBJTBA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
240.128 g/mol |
| Nominal Mass |
240 u |
| Quality |
993 |
| Retention Index |
1187 |
| SMILES |
C(CCCC)CCCI |
| SPLASH |
splash10-052f-9000000000-0d43b72b8cff75a0a074 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-n-Octyl iodide
1-iodooctane |
| Technique |
GC/MS |
| Wiley ID |
DD2024_010359 |
