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2-ANILINOMETHYLEN-CYCLOPENTENONE
SpectraBase Compound ID z2Sy2s0b2i
InChI InChI=1S/C12H13NO/c14-12-8-4-5-10(12)9-13-11-6-2-1-3-7-11/h1-3,6-7,9,13H,4-5,8H2/b10-9-
InChIKey NJPHRABPGJLGHX-KTKRTIGZSA-N
Mol Weight 187.24 g/mol
Molecular Formula C12H13NO
Exact Mass 187.099714 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3PLMGPNttyS
Name 2-ANILINOMETHYLEN-CYCLOPENTENONE
Compound Number 12Z
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13NO
InChI InChI=1S/C12H13NO/c14-12-8-4-5-10(12)9-13-11-6-2-1-3-7-11/h1-3,6-7,9,13H,4-5,8H2/b10-9-
InChIKey NJPHRABPGJLGHX-KTKRTIGZSA-N
Literature Reference Author L.KOZERSKI,R.KAWECKI,P.KRAJEWSKI,B.KWIECIEN,D.W.BOYKIN,S.BOL VIG,P.E.HANSEN
Literature Reference Citation MAGN.RES.CHEM.,36,921(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(199812)36:12<921::aid-omr392>3.0.co;2-r
Solvent CDCl3:CH3CN=1:1
Source File Reference UWSI9844