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6-(N-(1-oxopropyl)-3-butynylaminomethyl)-5-chloro-3-phenyl-1-benzyl-2(1H)-pyrazinone
SpectraBase Compound ID 7sCfxkFoLyE
InChI InChI=1S/C25H24ClN3O2/c1-3-5-16-28(22(30)4-2)18-21-24(26)27-23(20-14-10-7-11-15-20)25(31)29(21)17-19-12-8-6-9-13-19/h1,6-15H,4-5,16-18H2,2H3
InChIKey FXXUJEBNBLXTBQ-UHFFFAOYSA-N
Mol Weight 433.94 g/mol
Molecular Formula C25H24ClN3O2
Exact Mass 433.155705 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GJ6BXjinhfo
Name 6-(N-(1-oxopropyl)-3-butynylaminomethyl)-5-chloro-3-phenyl-1-benzyl-2(1H)-pyrazinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H24ClN3O2
InChI InChI=1S/C25H24ClN3O2/c1-3-5-16-28(22(30)4-2)18-21-24(26)27-23(20-14-10-7-11-15-20)25(31)29(21)17-19-12-8-6-9-13-19/h1,6-15H,4-5,16-18H2,2H3
InChIKey FXXUJEBNBLXTBQ-UHFFFAOYSA-N
Molecular Weight 433.939 g/mol
SMILES C=1(N(C(=O)C(=NC1Cl)c1ccccc1)Cc1ccccc1)CN(C(=O)CC)CCC#C
SPLASH splash10-0006-9001000000-4e4b05b07ef113312a70
Source of Spectrum F-52-9172-12
Synonyms N-[(1-benzyl-3-chloro-6-oxo-5-phenyl-1,6-dihydro-2-pyrazinyl)methyl]-N-(3-butynyl)propanamide
Wiley ID 797310