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4-Butyl-N-(4-butylbenzoyl)-N-phenylbenzamide
SpectraBase Compound ID KwowWSy0KVe
InChI InChI=1S/C28H31NO2/c1-3-5-10-22-14-18-24(19-15-22)27(30)29(26-12-8-7-9-13-26)28(31)25-20-16-23(17-21-25)11-6-4-2/h7-9,12-21H,3-6,10-11H2,1-2H3
InChIKey VWKNZPWTYOCVRT-UHFFFAOYSA-N
Mol Weight 413.56 g/mol
Molecular Formula C28H31NO2
Exact Mass 413.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HGKLarq2V6
Name 4-Butyl-N-(4-butylbenzoyl)-N-phenylbenzamide
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 413.235479240 u
Formula C28H31NO2
InChI InChI=1S/C28H31NO2/c1-3-5-10-22-14-18-24(19-15-22)27(30)29(26-12-8-7-9-13-26)28(31)25-20-16-23(17-21-25)11-6-4-2/h7-9,12-21H,3-6,10-11H2,1-2H3
InChIKey VWKNZPWTYOCVRT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 413.561 g/mol
Nominal Mass 413 u
Quality 971
Retention Index 3261
SMILES C=1(N(C(C2=CC=C(C=C2)CCCC)=O)C(C=2C=CC(=CC2)CCCC)=O)C=CC=CC1
SPLASH splash10-03di-2900000000-6c6ce766c4984d13a222
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_027969