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TRANS-3-METHYL-4-OXO-4A,5,8,8A-TETRAHYDROQUINAZOLINE-2(1H)-THIONE

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TRANS-3-METHYL-4-OXO-4A,5,8,8A-TETRAHYDROQUINAZOLINE-2(1H)-THIONE
SpectraBase Compound ID I98RoPX7MbE
InChI InChI=1S/C9H12N2OS/c1-11-8(12)6-4-2-3-5-7(6)10-9(11)13/h2-3,6-7H,4-5H2,1H3,(H,10,13)/t6-,7-/m1/s1
InChIKey BARLOKXZFMIHNW-RNFRBKRXSA-N
Mol Weight 196.27 g/mol
Molecular Formula C9H12N2OS
Exact Mass 196.067034 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1OEesV4eHDX
Name TRANS-3-METHYL-4-OXO-4A,5,8,8A-TETRAHYDROQUINAZOLINE-2(1H)-THIONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H12N2OS
InChI InChI=1S/C9H12N2OS/c1-11-8(12)6-4-2-3-5-7(6)10-9(11)13/h2-3,6-7H,4-5H2,1H3,(H,10,13)/t6-,7-/m1/s1
InChIKey BARLOKXZFMIHNW-RNFRBKRXSA-N
Instrument Name Bruker WM-250
Literature Reference J.PINTYE, G.BERNATH, L.MOD, P.SOHAR (1985) Acta Chimica Hungarica: v.118, N1,71-78.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo