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6-(3-Butynylaminomethyl)-3-methoxy-5-chloro-1-phenyl-2(1H)-pyrazinone
SpectraBase Compound ID 3tgQD309cgJ
InChI InChI=1S/C16H16ClN3O2/c1-3-4-10-18-11-13-14(17)19-15(22-2)16(21)20(13)12-8-6-5-7-9-12/h1,5-9,18H,4,10-11H2,2H3
InChIKey IYARMJLKJQOQSM-UHFFFAOYSA-N
Mol Weight 317.78 g/mol
Molecular Formula C16H16ClN3O2
Exact Mass 317.093104 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EPwBDMRcHso
Name 6-(3-Butynylaminomethyl)-3-methoxy-5-chloro-1-phenyl-2(1H)-pyrazinone
Comments Less than 3 mono-isotopic peaks
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Formula C16H16ClN3O2
InChI InChI=1S/C16H16ClN3O2/c1-3-4-10-18-11-13-14(17)19-15(22-2)16(21)20(13)12-8-6-5-7-9-12/h1,5-9,18H,4,10-11H2,2H3
InChIKey IYARMJLKJQOQSM-UHFFFAOYSA-N
Molecular Weight 317.776 g/mol
SMILES N(CC=1N(C(C(=NC1Cl)OC)=O)c1ccccc1)CCC#C
SPLASH splash10-0002-0091000000-949a8b83ff299acd730f
Source of Spectrum F-52-9171-11
Synonyms 6-[(3-butynylamino)methyl]-5-chloro-3-methoxy-1-phenyl-2(1H)-pyrazinone
Wiley ID 797315