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BXLVHSGJSIWMBF-UHFFFAOYSA-N
SpectraBase Compound ID B7gsc4Ri8nz
InChI InChI=1S/C16H16N4S/c1-21-16(13(10-19)11-20)15-7-5-3-2-4-6-14(15)12(8-17)9-18/h15H,2-7H2,1H3
InChIKey BXLVHSGJSIWMBF-UHFFFAOYSA-N
Mol Weight 296.39 g/mol
Molecular Formula C16H16N4S
Exact Mass 296.109568 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5KAN1MAGkrc
Name BXLVHSGJSIWMBF-UHFFFAOYSA-N
Compound Number 1,N=4,EXO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H16N4S
InChI InChI=1S/C16H16N4S/c1-21-16(13(10-19)11-20)15-7-5-3-2-4-6-14(15)12(8-17)9-18/h15H,2-7H2,1H3
InChIKey BXLVHSGJSIWMBF-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 296.390 g/mol
Solvent CDCl3
Source File Reference UWRU10130