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4-Butyl-N-(4-butylbenzoyl)-N-(2-methylphenyl)benzamide
SpectraBase Compound ID JIsxybgWJNQ
InChI InChI=1S/C29H33NO2/c1-4-6-11-23-14-18-25(19-15-23)28(31)30(27-13-9-8-10-22(27)3)29(32)26-20-16-24(17-21-26)12-7-5-2/h8-10,13-21H,4-7,11-12H2,1-3H3
InChIKey VWJCGCVZCQFGEP-UHFFFAOYSA-N
Mol Weight 427.6 g/mol
Molecular Formula C29H33NO2
Exact Mass 427.251129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGWhJQfDGyG
Name 4-Butyl-N-(4-butylbenzoyl)-N-(2-methylphenyl)benzamide
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 427.251129305 u
Formula C29H33NO2
InChI InChI=1S/C29H33NO2/c1-4-6-11-23-14-18-25(19-15-23)28(31)30(27-13-9-8-10-22(27)3)29(32)26-20-16-24(17-21-26)12-7-5-2/h8-10,13-21H,4-7,11-12H2,1-3H3
InChIKey VWJCGCVZCQFGEP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 427.588 g/mol
Nominal Mass 427 u
Quality 962
Retention Index 3316
SMILES C=1(N(C(C2=CC=C(C=C2)CCCC)=O)C(C=2C=CC(=CC2)CCCC)=O)C(=CC=CC1)C
SPLASH splash10-03di-2900100000-e3912440d2c2e4889c8d
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_028130