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3-[2-(2,4-Dichlorophenyl)ethenyl]-4,5,6,7-tetrahydroisoxazolo[4,3-c]pyridin-4-one
SpectraBase Compound ID BfYb2lkfFSs
InChI InChI=1S/C14H10Cl2N2O2/c15-9-3-1-8(10(16)7-9)2-4-12-13-11(18-20-12)5-6-17-14(13)19/h1-4,7H,5-6H2,(H,17,19)/b4-2+
InChIKey UELBKXPDBFXRKY-DUXPYHPUSA-N
Mol Weight 309.15 g/mol
Molecular Formula C14H10Cl2N2O2
Exact Mass 308.011933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gc6LcWR3kdR
Name 3-[2-(2,4-Dichlorophenyl)ethenyl]-4,5,6,7-tetrahydroisoxazolo[4,3-c]pyridin-4-one
Appearance Off-white solid
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Formula C14H10Cl2N2O2
InChI InChI=1S/C14H10Cl2N2O2/c15-9-3-1-8(10(16)7-9)2-4-12-13-11(18-20-12)5-6-17-14(13)19/h1-4,7H,5-6H2,(H,17,19)/b4-2+
InChIKey UELBKXPDBFXRKY-DUXPYHPUSA-N
Instrument Name Joel SX-102
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.33
Molecular Weight 309.152 g/mol
Reported Formula C14H10(35)Cl2N2O2
SMILES N1C(c2c(CC1)noc2\C=C\c1c(cc(cc1)Cl)Cl)=O
SPLASH splash10-0w90-5910000000-ebc496bb10cb5a66118a
Source of Spectrum BJO-8-SM6-8d
Wiley ID 1865038