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3-(p-Methylphenyl)-4-[5-(2-chlorophenyl)-.delta.(2)-1,2,4-oxadiazolin-3-yl]sydnone
SpectraBase Compound ID 8JMaVArqaES
InChI InChI=1S/C17H13ClN4O3/c1-10-6-8-11(9-7-10)22-14(17(23)25-21-22)15-19-16(24-20-15)12-4-2-3-5-13(12)18/h2-9,16H,1H3,(H-,19,20,21,23)
InChIKey BMIVHJNCCZNNHS-UHFFFAOYSA-N
Mol Weight 356.77 g/mol
Molecular Formula C17H13ClN4O3
Exact Mass 356.067618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3YOqWPmY0aw
Name 3-(p-Methylphenyl)-4-[5-(2-chlorophenyl)-.delta.(2)-1,2,4-oxadiazolin-3-yl]sydnone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13ClN4O3
InChI InChI=1S/C17H13ClN4O3/c1-10-6-8-11(9-7-10)22-14(17(23)25-21-22)15-19-16(24-20-15)12-4-2-3-5-13(12)18/h2-9,16H,1H3,(H-,19,20,21,23)
InChIKey BMIVHJNCCZNNHS-UHFFFAOYSA-N
Molecular Weight 356.769 g/mol
SMILES N1C(ON=C1c1[n+](noc1[O-])-c1ccc(cc1)C)c1c(Cl)cccc1
SPLASH splash10-0007-9076000000-0ae270faa3052fffb81b
Source of Spectrum QA-33-67-5
Wiley ID 861069