SpectraBase Spectrum ID |
JGa68WB8VCi |
Name |
N-Butyl-4-fluorobenzylamine |
CAS Registry Number |
60509-35-5 |
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/c1-2-3-8-13-9-10-4-6-11(12)7-5-10/h4-7,13H,2-3,8-9H2,1H3 |
InChIKey |
SZEFNSDEEORQSF-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
181.254 g/mol |
Nominal Mass |
181 u |
Quality |
989 |
Retention Index |
1311 |
SMILES |
C1(CNCCCC)=CC=C(C=C1)F |
SPLASH |
splash10-0a4i-3900000000-2cf3aa8ef5e2eb763103 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-(4-Fluorobenzyl)-1-butanamine
N-4-Fluorobenzylbutanamine
N-Butyl-4-fluorobenzenemethanamine
N-(4-Fluorobenzyl)butan-1-amine |
Technique |
GC/MS |
Wiley ID |
DD2024_009554 |