SpectraBase Spectrum ID |
DoeNmMImCxc |
Name |
N-Butyl-2-fluorobenzylamine |
CAS Registry Number |
60509-33-3 |
Classification |
Chemical |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
181.126677682 u |
Formula |
C11H16FN |
InChI |
InChI=1S/C11H16FN/c1-2-3-8-13-9-10-6-4-5-7-11(10)12/h4-7,13H,2-3,8-9H2,1H3 |
InChIKey |
WSMSXSDYRRSIRN-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
181.254 g/mol |
Nominal Mass |
181 u |
Quality |
759 |
Retention Index |
1305 |
SMILES |
C=1(C(=CC=CC1)F)CNCCCC |
SPLASH |
splash10-0a4r-1900000000-78a1cee3197b58ae6d26 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-(2-Fluorobenzyl)-1-butanamine
N-2-Fluorobenzylbutanamine
N-Butyl,N-(2-fluorobenzyl)amine
N-Butyl-2-fluorobenzenemethanamine
N-(2-Fluorobenzyl)butan-1-amine |
Technique |
GC/MS |
Wiley ID |
DD2024_013197 |