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1-Cyano-1-methoxycarbonyl-isoindolino(2,1-C)D/2/-triazoline
SpectraBase Compound ID 56nqVDWOyXb
InChI InChI=1S/C12H10N4O2/c1-18-11(17)12(7-13)10-9-5-3-2-4-8(9)6-16(10)15-14-12/h2-5,10H,6H2,1H3
InChIKey BADNMGVJVZYJON-UHFFFAOYSA-N
Mol Weight 242.24 g/mol
Molecular Formula C12H10N4O2
Exact Mass 242.080376 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FGZVjFiHgyv
Name 1-Cyano-1-methoxycarbonyl-isoindolino(2,1-C)D/2/-triazoline
CAS Registry Number 69540-43-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H10N4O2
InChI InChI=1S/C12H10N4O2/c1-18-11(17)12(7-13)10-9-5-3-2-4-8(9)6-16(10)15-14-12/h2-5,10H,6H2,1H3
InChIKey BADNMGVJVZYJON-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference P. Kolsaker, P.O. Ellingsen, G. Woien, Acta Chem. Scand. B32, 683 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CHCl3