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4-Methyl-3-[2-(4-methylphenylthio)ethyl]sydnone
SpectraBase Compound ID 6Tc88N0j0Vg
InChI InChI=1S/C12H14N2O2S/c1-9-3-5-11(6-4-9)17-8-7-14-10(2)12(15)16-13-14/h3-6H,7-8H2,1-2H3
InChIKey LPUYKZMYGIURBD-UHFFFAOYSA-N
Mol Weight 250.32 g/mol
Molecular Formula C12H14N2O2S
Exact Mass 250.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9KfkrdOPLH9
Name 4-Methyl-3-[2-(4-methylphenylthio)ethyl]sydnone
Alternate Name(s) 4-Methyl-3-[2-(4-methylphenyl)sulfanylethyl]-2H-1,2,3-oxadiazol-3-ium-5-one 4-Methyl-3-[2-(4-methylphenyl)sulfanylethyl]-2H-oxadiazol-3-ium-5-one 4-Methyl-3-[2-(p-tolylsulfanyl)ethyl]-2H-oxadiazol-3-ium-5-one 4-Methyl-3-[2-(p-tolylthio)ethyl]-2H-oxadiazol-3-ium-5-one 4-Methyl-3-[2-[(4-methylphenyl)thio]ethyl]-2H-oxadiazol-3-ium-5-one 4-Methyl-3-{2-[(4-methylphenyl)sulfanyl]ethyl}-5-oxo-2,5-dihydro-1,2,3-oxadiazol-3-ium
CAS Registry Number 53492-47-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O2S
InChI InChI=1S/C12H14N2O2S/c1-9-3-5-11(6-4-9)17-8-7-14-10(2)12(15)16-13-14/h3-6H,7-8H2,1-2H3
InChIKey LPUYKZMYGIURBD-UHFFFAOYSA-N
Molecular Weight 250.316 g/mol
SMILES c1(on[n+](c1C)CCSc1ccc(cc1)C)[O-]
SPLASH splash10-0fk9-6900000000-f675c762d00322e950c1
Source of Spectrum W5-1989-35594-29942
Wiley ID 1252943