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3-[4'-(4'',5''-Dihydro-5"-phenyl-1H-pyrazol-3"-yl)phenyl]-Sydnone
SpectraBase Compound ID KRanHYXyD2A
InChI InChI=1S/C17H14N4O2/c22-17-11-21(20-23-17)14-8-6-13(7-9-14)16-10-15(18-19-16)12-4-2-1-3-5-12/h1-9,11,15H,10H2,(H-,18,20,22)
InChIKey JXVLKFZUSWALTC-UHFFFAOYSA-N
Mol Weight 306.32 g/mol
Molecular Formula C17H14N4O2
Exact Mass 306.111676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HquEMIHi3bB
Name 3-[4'-(4'',5''-Dihydro-5"-phenyl-1H-pyrazol-3"-yl)phenyl]-Sydnone
Alternate Name(s) 3-[4-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phenyl]-5-oxadiazol-3-iumolate 3-[4-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phenyl]oxadiazol-3-ium-5-olate 3-[4-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)phenyl]-1,2,3-oxadiazol-3-ium-5-olate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N4O2
InChI InChI=1S/C17H14N4O2/c22-17-11-21(20-23-17)14-8-6-13(7-9-14)16-10-15(18-19-16)12-4-2-1-3-5-12/h1-9,11,15H,10H2,(H-,18,20,22)
InChIKey JXVLKFZUSWALTC-UHFFFAOYSA-N
Molecular Weight 306.325 g/mol
SMILES N1C(CC(=N1)c1ccc(-[n+]2noc(c2)[O-])cc1)c1ccccc1
SPLASH splash10-014i-6904000000-3680691c04156e65cf27
Source of Spectrum Y5-73-134-4d
Wiley ID 1695618