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1,5-BIS-(3,5-DIMETHYLPYRAZOL-1-YL)3-THIAPENTANE
SpectraBase Compound ID YtRus2her2
InChI InChI=1S/C14H22N4S/c1-11-9-13(3)17(15-11)5-7-19-8-6-18-14(4)10-12(2)16-18/h9-10H,5-8H2,1-4H3
InChIKey SHOWVMXLBXUGTG-UHFFFAOYSA-N
Mol Weight 278.42 g/mol
Molecular Formula C14H22N4S
Exact Mass 278.156518 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID cXNaAaBmC4
Name 1,5-BIS-(3,5-DIMETHYLPYRAZOL-1-YL)3-THIAPENTANE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H22N4S
InChI InChI=1S/C14H22N4S/c1-11-9-13(3)17(15-11)5-7-19-8-6-18-14(4)10-12(2)16-18/h9-10H,5-8H2,1-4H3
InChIKey SHOWVMXLBXUGTG-UHFFFAOYSA-N
Literature Reference Author A.S.POOTAPV,N.P.CHERNOVA,V.D.OGORODNIKOV,T.V.PETRENKO,A.I.KH LEBNIKOV
Literature Reference Citation BEIL.J.ORG.CHEM.,7,1526(2011)
Literature Reference DOI 10.3762/bjoc.7.179
Molecular Weight 278.415 g/mol
Solvent CDCl3
Source File Reference UWBT9713