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4-Chlorobenzylamine 4-butylbenzoyl
SpectraBase Compound ID 5fp0sv4i04E
InChI InChI=1S/C18H20ClNO/c1-2-3-4-14-5-9-16(10-6-14)18(21)20-13-15-7-11-17(19)12-8-15/h5-12H,2-4,13H2,1H3,(H,20,21)
InChIKey FJZFGBYISIAJNJ-UHFFFAOYSA-N
Mol Weight 301.82 g/mol
Molecular Formula C18H20ClNO
Exact Mass 301.123342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FgXXgsR1Si
Name 4-Chlorobenzylamine 4-butylbenzoyl
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 301.123341967 u
Formula C18H20ClNO
InChI InChI=1S/C18H20ClNO/c1-2-3-4-14-5-9-16(10-6-14)18(21)20-13-15-7-11-17(19)12-8-15/h5-12H,2-4,13H2,1H3,(H,20,21)
InChIKey FJZFGBYISIAJNJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 301.817 g/mol
Nominal Mass 301 u
Quality 943
Retention Index 2245
SMILES C=1(C(NCC=2C=CC(=CC2)Cl)=O)C=CC(=CC1)CCCC
SPLASH splash10-0ik9-5903000000-6c442be9da62d6adc865
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-Butyl-N-(4-chlorobenzyl)benzamide
Technique GC/MS
Wiley ID DD2024_023746