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4-METHYLTHIO-2,3,7,8,9,10-HEXAHYDRO-1,3A,5,6,10C-PENTAAZAACEPHENANTHRYLENE
SpectraBase Compound ID 5bYvcKkRsTy
InChI InChI=1S/C12H15N5S/c1-18-12-15-11-14-9-5-3-2-4-8(9)10-13-6-7-16(12)17(10)11/h2-7H2,1H3
InChIKey JUXOHEKBYFDOCG-UHFFFAOYSA-N
Mol Weight 261.35 g/mol
Molecular Formula C12H15N5S
Exact Mass 261.104817 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5G0XSOVWcJo
Name 4-METHYLTHIO-2,3,7,8,9,10-HEXAHYDRO-1,3A,5,6,10C-PENTAAZAACEPHENANTHRYLENE
Compound Number 9/1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15N5S
InChI InChI=1S/C12H15N5S/c1-18-12-15-11-14-9-5-3-2-4-8(9)10-13-6-7-16(12)17(10)11/h2-7H2,1H3
InChIKey JUXOHEKBYFDOCG-UHFFFAOYSA-N
Literature Reference Author G.BERECZ,L.PARKANYI,A.KALMAN,J.REITER
Literature Reference Citation J.HETCYCL.CHEM.,39,703(2002)
Literature Reference DOI 10.1002/jhet.5570390415
Molecular Weight 261.345 g/mol
Solvent CDCl3
Source File Reference UWSI8757