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PGDUBBHLLGJCKH-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

PGDUBBHLLGJCKH-UHFFFAOYSA-N
SpectraBase Compound ID K6D8NttG5pu
InChI InChI=1S/C16H22N4S/c1-2-4-8-12-18-15(17-11-7-3-1)20-16-19-13-9-5-6-10-14(13)21-16/h5-6,9-10H,1-4,7-8,11-12H2,(H2,17,18,19,20)
InChIKey PGDUBBHLLGJCKH-UHFFFAOYSA-N
Mol Weight 302.44 g/mol
Molecular Formula C16H22N4S
Exact Mass 302.156518 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8PSNySSGPsS
Name PGDUBBHLLGJCKH-UHFFFAOYSA-N
Compound Number 10J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22N4S
InChI InChI=1S/C16H22N4S/c1-2-4-8-12-18-15(17-11-7-3-1)20-16-19-13-9-5-6-10-14(13)21-16/h5-6,9-10H,1-4,7-8,11-12H2,(H2,17,18,19,20)
InChIKey PGDUBBHLLGJCKH-UHFFFAOYSA-N
Literature Reference Author A.CRUZ,I.I.PADILLA-MARTINEZ,E.V.GARCIA-BAEZ
Literature Reference Citation MOLECULES,17,10178(2012)
Literature Reference DOI 10.3390/molecules170910178
Molecular Weight 302.437 g/mol
Sample ID 628
Solvent CDCl3