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Sydnone, 3-phenyl-4-(2-phenyl-4-thiazolyl)-
SpectraBase Compound ID JbCAjMfQgeg
InChI InChI=1S/C17H11N3O2S/c21-17-15(20(19-22-17)13-9-5-2-6-10-13)14-11-23-16(18-14)12-7-3-1-4-8-12/h1-11H
InChIKey GXLCRMPIHSMDFA-UHFFFAOYSA-N
Mol Weight 321.35 g/mol
Molecular Formula C17H11N3O2S
Exact Mass 321.057198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CYlYb1RZuFz
Name Sydnone, 3-phenyl-4-(2-phenyl-4-thiazolyl)-
Alternate Name(s) 3-phenyl-4-(2-phenyl-1,3-thiazol-4-yl)-1,2,3-oxadiazol-3-ium-5-olate 3-Phenyl-4-(2-phenyl-4-thiazoly)sydnone
CAS Registry Number 94035-73-1
Comments Less than 3 mono-isotopic peaks
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Formula C17H11N3O2S
InChI InChI=1S/C17H11N3O2S/c21-17-15(20(19-22-17)13-9-5-2-6-10-13)14-11-23-16(18-14)12-7-3-1-4-8-12/h1-11H
InChIKey GXLCRMPIHSMDFA-UHFFFAOYSA-N
Molecular Weight 321.354 g/mol
SMILES c1([n+](noc1[O-])-c1ccccc1)-c1nc(-c2ccccc2)sc1
SPLASH splash10-03di-0093000000-2b9ee0096ebdbc49d364
Source of Spectrum AJ-57-1364-3
Wiley ID 1320867