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QLEKHZGQMKVQLQ-UHFFFAOYSA-N

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QLEKHZGQMKVQLQ-UHFFFAOYSA-N
SpectraBase Compound ID 4FBFTVyboH9
InChI InChI=1S/C14H13N3S/c1-9-10-5-4-7-11(10)16-17(9)14-15-12-6-2-3-8-13(12)18-14/h2-3,6,8H,4-5,7H2,1H3
InChIKey QLEKHZGQMKVQLQ-UHFFFAOYSA-N
Mol Weight 255.34 g/mol
Molecular Formula C14H13N3S
Exact Mass 255.083019 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 99vVuPUMJcs
Name QLEKHZGQMKVQLQ-UHFFFAOYSA-N
Compound Number 1046
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H13N3S
InChI InChI=1S/C14H13N3S/c1-9-10-5-4-7-11(10)16-17(9)14-15-12-6-2-3-8-13(12)18-14/h2-3,6,8H,4-5,7H2,1H3
InChIKey QLEKHZGQMKVQLQ-UHFFFAOYSA-N
Literature Reference Author M.BEGTRUP,G.BOYER,P.CABILDO,C.CATIVIELA,R.M.CLARAMUNT,J.ELGU ERO,J.I.GARCIA,C.TOI
Literature Reference Citation MAGN.RES.CHEM.,31,107(1993)
Literature Reference DOI 10.1002/mrc.1260310202
Molecular Weight 255.337 g/mol
Solvent CDCl3
Source File Reference UWVP1147