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8-(5-Nitro-pyridinyl-2)-6-endo-(4-chloro-phenyl)-8-aza-bicyclo(3.2.1)oct-3-en-2-one
SpectraBase Compound ID DIjxnhdgaNt
InChI InChI=1S/C18H14ClN3O3/c19-12-3-1-11(2-4-12)14-9-16-17(23)7-6-15(14)21(16)18-8-5-13(10-20-18)22(24)25/h1-8,10,14-16H,9H2/t14?,15-,16-/m1/s1
InChIKey AWIYTXUDNDHHFY-ANGDWKNPSA-N
Mol Weight 355.78 g/mol
Molecular Formula C18H14ClN3O3
Exact Mass 355.072369 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FxwRY4v0rdp
Name 8-(5-Nitro-pyridinyl-2)-6-endo-(4-chloro-phenyl)-8-aza-bicyclo(3.2.1)oct-3-en-2-one
CAS Registry Number 62219-62-9
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C18H14ClN3O3
InChI InChI=1S/C18H14ClN3O3/c19-12-3-1-11(2-4-12)14-9-16-17(23)7-6-15(14)21(16)18-8-5-13(10-20-18)22(24)25/h1-8,10,14-16H,9H2/t14?,15-,16-/m1/s1
InChIKey AWIYTXUDNDHHFY-ANGDWKNPSA-N
Instrument Name Jeol FX-100
Literature Reference A.R. Katritzky, N. Dennis, G.J. Sabongi, Org. Magn. Resonance 12, 357 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6