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2-(3',5'-Dichlorphenyl)-5-methoxy-1,2,4-triazolin-3-one
SpectraBase Compound ID C8ubRqmZTe3
InChI InChI=1S/C9H7Cl2N3O2/c1-16-8-12-9(15)14(13-8)7-3-5(10)2-6(11)4-7/h2-4H,1H3,(H,12,13,15)
InChIKey NDZLCPQTFQXYNY-UHFFFAOYSA-N
Mol Weight 260.08 g/mol
Molecular Formula C9H7Cl2N3O2
Exact Mass 258.991532 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EAOz4ZssQP7
Name 2-(3',5'-DICHLORPHENYL)-5-METHOXY-1,2,4-TRIAZOLIN-3-ONE
CAS Registry Number 81012-76-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H7Cl2N3O2
InChI InChI=1S/C9H7Cl2N3O2/c1-16-8-12-9(15)14(13-8)7-3-5(10)2-6(11)4-7/h2-4H,1H3,(H,12,13,15)
InChIKey NDZLCPQTFQXYNY-UHFFFAOYSA-N
Literature Reference Author S.S.JONES,D.B.STAIGER,D.F.CHODOSH
Literature Reference Citation J.ORG.CHEM.,47,1969(1982)
Literature Reference DOI 10.1021/jo00349a031
Molecular Weight 260.079 g/mol
Solvent DMSO-D6
Source File Reference UNIW18671