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2-METHYLTHIO-6-(PHENYLSULFONYL)-5,6,7,8-TETRAHYDRO-3H-QUINAZOLIN-4-ONE
SpectraBase Compound ID DOteddnkFPC
InChI InChI=1S/C15H16N2O3S2/c1-21-15-16-13-8-7-11(9-12(13)14(18)17-15)22(19,20)10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,16,17,18)
InChIKey SMQZAQFOIQEUEF-UHFFFAOYSA-N
Mol Weight 336.42 g/mol
Molecular Formula C15H16N2O3S2
Exact Mass 336.060235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CfGjV66UMkI
Name 2-METHYLTHIO-6-(PHENYLSULFONYL)-5,6,7,8-TETRAHYDRO-3H-QUINAZOLIN-4-ONE
Compound Number 12G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H16N2O3S2
InChI InChI=1S/C15H16N2O3S2/c1-21-15-16-13-8-7-11(9-12(13)14(18)17-15)22(19,20)10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,16,17,18)
InChIKey SMQZAQFOIQEUEF-UHFFFAOYSA-N
Literature Reference Author S.DALAI,V.N.BELOV,S.NIZAMOV,K.RAUCH,D.KINSINGER,A.D.MEIJERE
Literature Reference Citation EUR.J.ORG.CHEM.,2753(2006)
Molecular Weight 336.424 g/mol
Sample ID 43745
Solvent DMSO-D6