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PTYWNIUUDQNPJQ-UHFFFAOYSA-N
SpectraBase Compound ID Ks3vBxz9Zhr
InChI InChI=1S/C12H14N2S/c15-12-13-7-5-11-10-4-2-1-3-9(10)6-8-14(11)12/h1-4,11H,5-8H2,(H,13,15)
InChIKey PTYWNIUUDQNPJQ-UHFFFAOYSA-N
Mol Weight 218.32 g/mol
Molecular Formula C12H14N2S
Exact Mass 218.08777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AjkilTVPsLN
Name (+/-)-1,6,7,11B-TETRAHYDRO-2H-PYRIMIDO-[4,3-A]-ISOQUINOLINE-4(3H)-THIONE
Compound Number 19A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14N2S
InChI InChI=1S/C12H14N2S/c15-12-13-7-5-11-10-4-2-1-3-9(10)6-8-14(11)12/h1-4,11H,5-8H2,(H,13,15)
InChIKey PTYWNIUUDQNPJQ-UHFFFAOYSA-N
Literature Reference Author E.GOESSNITZER,A.PUNKENHOFER
Literature Reference Citation MH.CHEM.,134,909(2003)
Literature Reference DOI 10.1007/s00706-002-0559-7
Molecular Weight 218.317 g/mol
Solvent CDCl3
Source File Reference UWKP4079