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beta-Methylphenethylamine N-2-chlorobenzyl
SpectraBase Compound ID LTX4NpdXULG
InChI InChI=1S/C16H18ClN/c1-13(14-7-3-2-4-8-14)11-18-12-15-9-5-6-10-16(15)17/h2-10,13,18H,11-12H2,1H3
InChIKey NFKSXHPRNHOURZ-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 JJJnUmQRs5g
Name beta-Methylphenethylamine N-2-chlorobenzyl
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/c1-13(14-7-3-2-4-8-14)11-18-12-15-9-5-6-10-16(15)17/h2-10,13,18H,11-12H2,1H3
InChIKey NFKSXHPRNHOURZ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 259.780 g/mol
Nominal Mass 259 u
Quality 1000
Retention Index 2006
SMILES C1(=C(C=CC=C1)Cl)CNCC(C=1C=CC=CC1)C
SPLASH splash10-0fb9-2900000000-b850493213e153fdaf99
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(2-Chlorobenzyl)-2-phenylpropan-1-amine
Technique GC/MS
Wiley ID DD2024_022171