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N-Butyl-2-fluorobenzylamine
SpectraBase Compound ID 37tWimUNvut
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
Mol Weight 181.25 g/mol
Molecular Formula C11H16FN
Exact Mass 181.126678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2m1hI2kaudk
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 991
Retention Index 1299
SMILES C=1(C(=CC=CC1)F)CNCCCC
SPLASH splash10-0a4i-2900000000-dc10eb252a23d4f61c2d
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_005524