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8-CYClOPENTYL-3-PROPYL-6-THIOXANTHINE

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8-CYClOPENTYL-3-PROPYL-6-THIOXANTHINE
SpectraBase Compound ID Kwcs7OAzLie
InChI InChI=1S/C13H18N4OS/c1-2-7-17-11-9(12(19)16-13(17)18)14-10(15-11)8-5-3-4-6-8/h8H,2-7H2,1H3,(H,14,15)(H,16,18,19)
InChIKey XLOJURBVRGXPAV-UHFFFAOYSA-N
Mol Weight 278.37 g/mol
Molecular Formula C13H18N4OS
Exact Mass 278.120132 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6qw7eyul8C8
Name 8-CYClOPENTYL-3-PROPYL-6-THIOXANTHINE
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18N4OS
InChI InChI=1S/C13H18N4OS/c1-2-7-17-11-9(12(19)16-13(17)18)14-10(15-11)8-5-3-4-6-8/h8H,2-7H2,1H3,(H,14,15)(H,16,18,19)
InChIKey XLOJURBVRGXPAV-UHFFFAOYSA-N
Literature Reference Author J.SHIMADA,T.KURODA,F.SUZUKI
Literature Reference Citation J.HETCYCL.CHEM.,30,241(1993)
Literature Reference DOI 10.1002/jhet.5570300141
Molecular Weight 278.372 g/mol
Solvent DMSO-D6
Source File Reference UWPB208