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4-Bromophenethylamine 4-butylbenzoyl
SpectraBase Compound ID KNpzxvcV7DJ
InChI InChI=1S/C19H22BrNO/c1-2-3-4-15-5-9-17(10-6-15)19(22)21-14-13-16-7-11-18(20)12-8-16/h5-12H,2-4,13-14H2,1H3,(H,21,22)
InChIKey PWMIXXAEPPDPOI-UHFFFAOYSA-N
Mol Weight 360.3 g/mol
Molecular Formula C19H22BrNO
Exact Mass 359.088477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JF2eu3f9WIy
Name 4-Bromophenethylamine 4-butylbenzoyl
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 359.088477331 u
Formula C19H22BrNO
InChI InChI=1S/C19H22BrNO/c1-2-3-4-15-5-9-17(10-6-15)19(22)21-14-13-16-7-11-18(20)12-8-16/h5-12H,2-4,13-14H2,1H3,(H,21,22)
InChIKey PWMIXXAEPPDPOI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 360.295 g/mol
Nominal Mass 359 u
Quality 961
Retention Index 2542
SMILES C=1(C(NCCC2=CC=C(C=C2)Br)=O)C=CC(=CC1)CCCC
SPLASH splash10-03di-3900000000-91286d9b319a5efb61c0
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-[2-(4-Bromophenyl)ethyl]-4-butylbenzamide
Technique GC/MS
Wiley ID DD2024_023738