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4-Bromo-alpha-phenethylamine PENT
SpectraBase Compound ID 7g9u5I238SU
InChI InChI=1S/C13H18BrNO/c1-3-4-5-13(16)15-10(2)11-6-8-12(14)9-7-11/h6-10H,3-5H2,1-2H3,(H,15,16)
InChIKey QQJAGTNQLUAAFB-UHFFFAOYSA-N
Mol Weight 284.2 g/mol
Molecular Formula C13H18BrNO
Exact Mass 283.057177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Hp5p8ibISO
Name 4-Bromo-alpha-phenethylamine PENT
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 283.057177203 u
Formula C13H18BrNO
InChI InChI=1S/C13H18BrNO/c1-3-4-5-13(16)15-10(2)11-6-8-12(14)9-7-11/h6-10H,3-5H2,1-2H3,(H,15,16)
InChIKey QQJAGTNQLUAAFB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 284.197 g/mol
Nominal Mass 283 u
Quality 981
Retention Index 1979
SMILES C(C=1C=CC(=CC1)Br)(NC(CCCC)=O)C
SPLASH splash10-001r-5940000000-c40950f3f658f57776aa
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-(4-bromophenyl)ethyl)pentanamide
Technique GC/MS
Wiley ID DD2024_022050