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4-BROMO-3-[PARA-(3'-(4-CHLOROPHENYL)-ACRYL-1'-OYL)]-PHENYLSYDNONE
SpectraBase Compound ID GCKygLaHyYp
InChI InChI=1S/C17H10BrClN2O3/c18-16-17(23)24-20-21(16)14-8-4-12(5-9-14)15(22)10-3-11-1-6-13(19)7-2-11/h1-10H/b10-3+
InChIKey IYHYHQSSYTXOBI-XCVCLJGOSA-N
Mol Weight 405.64 g/mol
Molecular Formula C17H10BrClN2O3
Exact Mass 403.956333 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPxTuRap4Ff
Name 4-Bromo-3-[p-(3'-acryl-1'-oyl)phenyl]-sydnone
Alternate Name(s) 4-Bromo-3-[4-[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]phenyl]-5-oxadiazol-3-iumolate 4-Bromo-3-[4-[(E)-3-(4-chlorophenyl)prop-2-enoyl]phenyl]oxadiazol-3-ium-5-olate 4-Bromanyl-3-[4-[(E)-3-(4-chlorophenyl)prop-2-enoyl]phenyl]-1,2,3-oxadiazol-3-ium-5-olate
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Formula C17H10BrClN2O3
InChI InChI=1S/C17H10BrClN2O3/c18-16-17(23)24-20-21(16)14-8-4-12(5-9-14)15(22)10-3-11-1-6-13(19)7-2-11/h1-10H/b10-3+
InChIKey IYHYHQSSYTXOBI-XCVCLJGOSA-N
Molecular Weight 405.635 g/mol
SMILES c1([n+](noc1[O-])-c1ccc(C(\C=C\c2ccc(cc2)Cl)=O)cc1)Br
SPLASH splash10-00xs-0195200000-5a9451ebde940f221a0b
Source of Spectrum AJ-43-347-3
Wiley ID 1593915