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2-(Imidazol-1-yl)-6-(phenylsulfonyl)-5,6,7,8-tetrahydro-3H-quinazolin-4-one
SpectraBase Compound ID FLbp4WFopCM
InChI InChI=1S/C17H16N4O3S/c22-16-14-10-13(25(23,24)12-4-2-1-3-5-12)6-7-15(14)19-17(20-16)21-9-8-18-11-21/h1-5,8-9,11,13H,6-7,10H2,(H,19,20,22)
InChIKey WGJLTPAEXXYZOD-UHFFFAOYSA-N
Mol Weight 356.4 g/mol
Molecular Formula C17H16N4O3S
Exact Mass 356.094312 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IbWxMipfrKv
Name 2-(IMIDAZOL-1-YL)-6-(PHENYLSULFONYL)-5,6,7,8-TETRAHYDRO-3H-QUINAZOLIN-4-ONE
Compound Number 12O
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H16N4O3S
InChI InChI=1S/C17H16N4O3S/c22-16-14-10-13(25(23,24)12-4-2-1-3-5-12)6-7-15(14)19-17(20-16)21-9-8-18-11-21/h1-5,8-9,11,13H,6-7,10H2,(H,19,20,22)
InChIKey WGJLTPAEXXYZOD-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 356.399 g/mol
Sample ID 43774
Solvent DMSO-D6