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6-(N-Benzyl-2-propynylaminomethyl)-5-chloro-3-methoxy-1-phenyl-2(1H)-pyrazinone
SpectraBase Compound ID 6mPyt8EUY8b
InChI InChI=1S/C22H20ClN3O2/c1-3-14-25(15-17-10-6-4-7-11-17)16-19-20(23)24-21(28-2)22(27)26(19)18-12-8-5-9-13-18/h1,4-13H,14-16H2,2H3
InChIKey FXPMTWQYWVXILE-UHFFFAOYSA-N
Mol Weight 393.87 g/mol
Molecular Formula C22H20ClN3O2
Exact Mass 393.124405 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6EIUTSsrufZ
Name 6-(N-Benzyl-2-propynylaminomethyl)-5-chloro-3-methoxy-1-phenyl-2(1H)-pyrazinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20ClN3O2
InChI InChI=1S/C22H20ClN3O2/c1-3-14-25(15-17-10-6-4-7-11-17)16-19-20(23)24-21(28-2)22(27)26(19)18-12-8-5-9-13-18/h1,4-13H,14-16H2,2H3
InChIKey FXPMTWQYWVXILE-UHFFFAOYSA-N
Molecular Weight 393.874 g/mol
SMILES C=1(N(C(=O)C(=NC1Cl)OC)c1ccccc1)CN(Cc1ccccc1)CC#C
SPLASH splash10-00di-0910000000-1784d93fb0b69ff46c08
Source of Spectrum F-52-9170-10
Synonyms 6-{[benzyl(2-propynyl)amino]methyl}-5-chloro-3-methoxy-1-phenyl-2(1H)-pyrazinone
Wiley ID 797321