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N-Pentyl-3-bromobenzylamine
SpectraBase Compound ID 4J8ltNebOQs
InChI InChI=1S/C12H18BrN/c1-2-3-4-8-14-10-11-6-5-7-12(13)9-11/h5-7,9,14H,2-4,8,10H2,1H3
InChIKey JBXQBLGZXVYITJ-UHFFFAOYSA-N
Mol Weight 256.19 g/mol
Molecular Formula C12H18BrN
Exact Mass 255.062263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHXdsexPVZY
Name N-Pentyl-3-bromobenzylamine
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 255.062262584 u
Formula C12H18BrN
InChI InChI=1S/C12H18BrN/c1-2-3-4-8-14-10-11-6-5-7-12(13)9-11/h5-7,9,14H,2-4,8,10H2,1H3
InChIKey JBXQBLGZXVYITJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 256.187 g/mol
Nominal Mass 255 u
Quality 727
Retention Index 1700
SMILES C=1(CNCCCCC)C=C(C=CC1)Br
SPLASH splash10-0g4j-1930000000-01dfdd4f90cfa53ba07e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (3-Bromo-benzyl)pentylamine N-Pentyl-3-bromobenzenemethanamine N-(3-Bromobenzyl)pentan-1-amine
Technique GC/MS
Wiley ID DD2024_013152