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1-(2-(3,4-Dimethoxyphenyl)-1,1-difluoroallyl)pyridin-2(1H)-one
SpectraBase Compound ID 1CIwVtn5SGQ
InChI InChI=1S/C16H15F2NO3/c1-11(12-7-8-13(21-2)14(10-12)22-3)16(17,18)19-9-5-4-6-15(19)20/h4-10H,1H2,2-3H3
InChIKey DEWMLMYPOZEBFE-UHFFFAOYSA-N
Mol Weight 307.3 g/mol
Molecular Formula C16H15F2NO3
Exact Mass 307.102 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3msBqkCxC9O
Name 1-(2-(3,4-Dimethoxyphenyl)-1,1-difluoroallyl)pyridin-2(1H)-one
Appearance White solid
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Formula C16H15F2NO3
InChI InChI=1S/C16H15F2NO3/c1-11(12-7-8-13(21-2)14(10-12)22-3)16(17,18)19-9-5-4-6-15(19)20/h4-10H,1H2,2-3H3
InChIKey DEWMLMYPOZEBFE-UHFFFAOYSA-N
Instrument Name Waters GCT Premier
Ionization Type EI positive ion
Literature Reference DOI 10.1002/asia.202300144
Molecular Weight 307.297 g/mol
Quality 994
Reported Formula C16H15F2NO3
SMILES C(C(N1C=CC=CC1=O)(F)F)(C1=CC=C(C(=C1)OC)OC)=C
SPLASH splash10-0a4i-1595000000-375739735a064f28ecdc
Source of Spectrum CAJ-18-SM89-4ya (DOI: 10.1002/asia.202300144)
Wiley ID 1909853