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3-[2-(4-Bromophenyl)ethenyl]-4,5,6,7-tetrahydroisoxazolo[4,3-c]pyridin-4-one
SpectraBase Compound ID 617tUlS3Pg4
InChI InChI=1S/C14H11BrN2O2/c15-10-4-1-9(2-5-10)3-6-12-13-11(17-19-12)7-8-16-14(13)18/h1-6H,7-8H2,(H,16,18)/b6-3+
InChIKey FRDCBEQTQLKJSL-ZZXKWVIFSA-N
Mol Weight 319.16 g/mol
Molecular Formula C14H11BrN2O2
Exact Mass 318.000391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6onDzBPAL4T
Name 3-[2-(4-Bromophenyl)ethenyl]-4,5,6,7-tetrahydroisoxazolo[4,3-c]pyridin-4-one
Appearance White solid
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Formula C14H11BrN2O2
InChI InChI=1S/C14H11BrN2O2/c15-10-4-1-9(2-5-10)3-6-12-13-11(17-19-12)7-8-16-14(13)18/h1-6H,7-8H2,(H,16,18)/b6-3+
InChIKey FRDCBEQTQLKJSL-ZZXKWVIFSA-N
Instrument Name Joel SX-102
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.33
Molecular Weight 319.158 g/mol
Reported Formula C14H11BrN2O2
SMILES N1C(c2c(CC1)noc2\C=C\c1ccc(cc1)Br)=O
SPLASH splash10-0006-9703000000-483100cd0bc59c4e98f5
Source of Spectrum BJO-8-SM5-8c
Wiley ID 1865037