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3-(MESITYLAMINO)-PYRAZOLIN-5-ONE

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3-(MESITYLAMINO)-PYRAZOLIN-5-ONE
SpectraBase Compound ID 6pDxH1OEnxy
InChI InChI=1S/C12H15N3O/c1-7-4-8(2)12(9(3)5-7)13-10-6-11(16)15-14-10/h4-5H,6H2,1-3H3,(H,13,14)(H,15,16)
InChIKey DBGYQATYSUXFKM-UHFFFAOYSA-N
Mol Weight 217.27 g/mol
Molecular Formula C12H15N3O
Exact Mass 217.121512 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DWOiJruqjcm
Name 3-(MESITYLAMINO)-PYRAZOLIN-5-ONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15N3O
InChI InChI=1S/C12H15N3O/c1-7-4-8(2)12(9(3)5-7)13-10-6-11(16)15-14-10/h4-5H,6H2,1-3H3,(H,13,14)(H,15,16)
InChIKey DBGYQATYSUXFKM-UHFFFAOYSA-N
Literature Reference Author H.BIBAS,D.W.MOLONEY,R.NEUMANN,M.SHTAIWI,P.V.BERNHARDT,C.WENT RUP
Literature Reference Citation J.ORG.CHEM.,67,2619(2002)
Literature Reference DOI 10.1021/jo0110552
Molecular Weight 217.271 g/mol
Solvent DMSO-D6
Source File Reference UWSI21497