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N-[(3E)-3,4-Bis(benzoylamino)-3-butenyl]benzamide
SpectraBase Compound ID 2s9bkNTiG2I
InChI InChI=1S/C25H23N3O3/c29-23(19-10-4-1-5-11-19)26-17-16-22(28-25(31)21-14-8-3-9-15-21)18-27-24(30)20-12-6-2-7-13-20/h1-15,18H,16-17H2,(H,26,29)(H,27,30)(H,28,31)/b22-18+
InChIKey IKPHOBGYRSDTKN-RELWKKBWSA-N
Mol Weight 413.48 g/mol
Molecular Formula C25H23N3O3
Exact Mass 413.173942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6oVvqFlxv5g
Name N-[(3E)-3,4-Bis(benzoylamino)-3-butenyl]benzamide
Alternate Name(s) 3-Butenylamine, 3,4-dibenzoylamino-N-benzoyl-
CAS Registry Number 57118-79-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23N3O3
InChI InChI=1S/C25H23N3O3/c29-23(19-10-4-1-5-11-19)26-17-16-22(28-25(31)21-14-8-3-9-15-21)18-27-24(30)20-12-6-2-7-13-20/h1-15,18H,16-17H2,(H,26,29)(H,27,30)(H,28,31)/b22-18+
InChIKey IKPHOBGYRSDTKN-RELWKKBWSA-N
Molecular Weight 413.477 g/mol
SMILES N(CC\C(=C/NC(=O)c1ccccc1)NC(=O)c1ccccc1)C(=O)c1ccccc1
SPLASH splash10-0a4i-2910000000-ff7147cb8b7a0aa50048
Source of Spectrum NP-14-7387-0
Wiley ID 1111960