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(R-4A,T-5,T-8,C-8A)-5,8-ETHANO-3-PHENYL-2-THIOXO-2,3,4A,5,8,8A-HEXAHIDROQUINAZOLIN-4(1H)-ONE
SpectraBase Compound ID F9vtd2TNaZB
InChI InChI=1S/C16H16N2OS/c19-15-13-10-6-8-11(9-7-10)14(13)17-16(20)18(15)12-4-2-1-3-5-12/h1-6,8,10-11,13-14H,7,9H2,(H,17,20)/t10-,11+,13+,14-/m1/s1
InChIKey KJUKQLKCSYFFIX-UVLXDEKHSA-N
Mol Weight 284.38 g/mol
Molecular Formula C16H16N2OS
Exact Mass 284.098334 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2856yiFmCut
Name (R-4A,T-5,T-8,C-8A)-5,8-ETHANO-3-PHENYL-2-THIOXO-2,3,4A,5,8,8A-HEXAHIDROQUINAZOLIN-4(1H)-ONE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H16N2OS
InChI InChI=1S/C16H16N2OS/c19-15-13-10-6-8-11(9-7-10)14(13)17-16(20)18(15)12-4-2-1-3-5-12/h1-6,8,10-11,13-14H,7,9H2,(H,17,20)/t10-,11+,13+,14-/m1/s1
InChIKey KJUKQLKCSYFFIX-UVLXDEKHSA-N
Literature Reference Author M.PALKO,P.SOHAR,F.FUELOUP
Literature Reference Citation MOLECULES,16,7691(2011)
Literature Reference DOI 10.3390/molecules16097691
Molecular Weight 284.376 g/mol
Sample ID 192
Solvent CDCl3