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TRANS-3-PHENYL-4-OXO-4A,5,8,8A-TETRAHYDROQUINAZOLINE-2(1H)-THIONE
SpectraBase Compound ID BfrCAKQMIr5
InChI InChI=1S/C14H14N2OS/c17-13-11-8-4-5-9-12(11)15-14(18)16(13)10-6-2-1-3-7-10/h1-7,11-12H,8-9H2,(H,15,18)/t11-,12-/m1/s1
InChIKey HHGAUIGYNIOMQJ-VXGBXAGGSA-N
Mol Weight 258.34 g/mol
Molecular Formula C14H14N2OS
Exact Mass 258.082684 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 84IEZBt6AHo
Name TRANS-3-PHENYL-4-OXO-4A,5,8,8A-TETRAHYDROQUINAZOLINE-2(1H)-THIONE
Comments #
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H14N2OS
InChI InChI=1S/C14H14N2OS/c17-13-11-8-4-5-9-12(11)15-14(18)16(13)10-6-2-1-3-7-10/h1-7,11-12H,8-9H2,(H,15,18)/t11-,12-/m1/s1
InChIKey HHGAUIGYNIOMQJ-VXGBXAGGSA-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