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YNFLHHAZBGOFSS-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

YNFLHHAZBGOFSS-UHFFFAOYSA-N
SpectraBase Compound ID ol4x754XW7
InChI InChI=1S/C19H16ClN5OS/c1-4-9-22-19-24-16-14(10-21)17(27-3)23-11(2)15(16)18(26)25(19)13-7-5-12(20)6-8-13/h4-8H,1,9H2,2-3H3,(H,22,24)
InChIKey YNFLHHAZBGOFSS-UHFFFAOYSA-N
Mol Weight 397.88 g/mol
Molecular Formula C19H16ClN5OS
Exact Mass 397.076409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DKXxpisAL9i
Name YNFLHHAZBGOFSS-UHFFFAOYSA-N
Compound Number III-2
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H16ClN5OS
InChI InChI=1S/C19H16ClN5OS/c1-4-9-22-19-24-16-14(10-21)17(27-3)23-11(2)15(16)18(26)25(19)13-7-5-12(20)6-8-13/h4-8H,1,9H2,2-3H3,(H,22,24)
InChIKey YNFLHHAZBGOFSS-UHFFFAOYSA-N
Literature Reference Author G.XU,J.SONG,J.HE,Q.REN,W.MO,H.XU,S.SUN,H.HE,Y.CUI
Literature Reference Citation MAGN.RES.CHEM.,50,646(2012)
Literature Reference DOI 10.1002/mrc.3853
Molecular Weight 397.882 g/mol
Solvent CDCl3
Source File Reference UWLU82294