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N-(4-Chlorobenzyl)-3-phenyl-1-propylamine
SpectraBase Compound ID IBh85ZeEybx
InChI InChI=1S/C16H18ClN/c17-16-10-8-15(9-11-16)13-18-12-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-11,18H,4,7,12-13H2
InChIKey QMASEDPJKXGRCW-UHFFFAOYSA-N
Mol Weight 259.78 g/mol
Molecular Formula C16H18ClN
Exact Mass 259.112777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNKzVJVOjaz
Name N-(4-Chlorobenzyl)-3-phenyl-1-propylamine
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 259.112777284 u
Formula C16H18ClN
InChI InChI=1S/C16H18ClN/c17-16-10-8-15(9-11-16)13-18-12-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-11,18H,4,7,12-13H2
InChIKey QMASEDPJKXGRCW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 259.780 g/mol
Nominal Mass 259 u
Quality 987
Retention Index 2113
SMILES C=1(CNCCCC=2C=CC=CC2)C=CC(=CC1)Cl
SPLASH splash10-0fb9-2900000000-7513ff32fc285f1d227f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(4-Chlorobenzyl)-3-phenyl-1-propanamine N-(4-chlorobenzyl)-3-phenylpropan-1-amine
Technique GC/MS
Wiley ID DD2024_021752