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3-(p-Methylphenyl)-4-[5'-phenyl-4'-cyanoisoxazol-3'-yl]sydnone
SpectraBase Compound ID LSgXhLYb2kK
InChI InChI=1S/C19H12N4O3/c1-12-7-9-14(10-8-12)23-17(19(24)26-22-23)16-15(11-20)18(25-21-16)13-5-3-2-4-6-13/h2-10H,1H3
InChIKey VKLBSKULOSZNFX-UHFFFAOYSA-N
Mol Weight 344.33 g/mol
Molecular Formula C19H12N4O3
Exact Mass 344.09094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6b0gDqYLnvL
Name 3-(p-Methylphenyl)-4-[5'-phenyl-4'-cyanoisoxazol-3'-yl]sydnone
Comments Less than 3 mono-isotopic peaks
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Formula C19H12N4O3
InChI InChI=1S/C19H12N4O3/c1-12-7-9-14(10-8-12)23-17(19(24)26-22-23)16-15(11-20)18(25-21-16)13-5-3-2-4-6-13/h2-10H,1H3
InChIKey VKLBSKULOSZNFX-UHFFFAOYSA-N
Molecular Weight 344.330 g/mol
SMILES c1([n+](noc1[O-])-c1ccc(cc1)C)-c1c(c(-c2ccccc2)on1)C#N
SPLASH splash10-000i-0090000000-4adc17df27e0c67f0685
Source of Spectrum QA-39-167-4
Wiley ID 861421