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5-(4-Cyano-benzylidene)-hydantoin

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5-(4-Cyano-benzylidene)-hydantoin
SpectraBase Compound ID 9DlUetiY5xc
InChI InChI=1S/C11H7N3O2/c12-6-8-3-1-7(2-4-8)5-9-10(15)14-11(16)13-9/h1-5H,(H2,13,14,15,16)/b9-5+
InChIKey OBTKOWGJCLQKMO-WEVVVXLNSA-N
Mol Weight 213.2 g/mol
Molecular Formula C11H7N3O2
Exact Mass 213.053826 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID YnLVjQkexn
Name 5-(4-Cyano-benzylidene)-hydantoin
CAS Registry Number 113477-86-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H7N3O2
InChI InChI=1S/C11H7N3O2/c12-6-8-3-1-7(2-4-8)5-9-10(15)14-11(16)13-9/h1-5H,(H2,13,14,15,16)/b9-5+
InChIKey OBTKOWGJCLQKMO-WEVVVXLNSA-N
Instrument Name Jeol FX-90
Literature Reference S.F. Tan, K.P. Ang, H. Jayachandran, J. Chem. Soc. Perkin II 1043 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6