John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=9XHRDDQ6nat SpectraBase Spectrum ID=10zveqXr59z

(accessed ).
HKRLTWGKVKVSFJ-UHFFFAOYSA-N
SpectraBase Compound ID 9XHRDDQ6nat
InChI InChI=1S/C14H12N4S/c1-19-14(11(8-17)9-18)13-5-3-2-4-12(13)10(6-15)7-16/h13H,2-5H2,1H3
InChIKey HKRLTWGKVKVSFJ-UHFFFAOYSA-N
Mol Weight 268.34 g/mol
Molecular Formula C14H12N4S
Exact Mass 268.078268 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10zveqXr59z
Name HKRLTWGKVKVSFJ-UHFFFAOYSA-N
Compound Number 1,N=2,EXO
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12N4S
InChI InChI=1S/C14H12N4S/c1-19-14(11(8-17)9-18)13-5-3-2-4-12(13)10(6-15)7-16/h13H,2-5H2,1H3
InChIKey HKRLTWGKVKVSFJ-UHFFFAOYSA-N
Literature Reference Author E.KLEINPETER,M.HEYDENREICH,J.WOLLER,G.WOLF,A.KOCH,G.KEMPTER, K.PIHLAJA
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1877(1998)
Literature Reference DOI 10.1039/a803732i
Molecular Weight 268.336 g/mol
Solvent CDCl3
Source File Reference UWRU10128
SpectraBase Batch ID GqeyPiii9Lm