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(R)-5-IODO-4-OXO-2-PHENYL-3,4-DIHYDRO-2H-PYRIMIDINE-1(2H)-CARBOXYLIC-ACID-BENZYLESTER
SpectraBase Compound ID Ksmo8Td2V7w
InChI InChI=1S/C18H15IN2O3/c19-15-11-21(18(23)24-12-13-7-3-1-4-8-13)16(20-17(15)22)14-9-5-2-6-10-14/h1-11,16H,12H2,(H,20,22)/t16-/m1/s1
InChIKey DGOMTWNFAMVTRQ-MRXNPFEDSA-N
Mol Weight 434.23 g/mol
Molecular Formula C18H15IN2O3
Exact Mass 434.012737 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CCV3d8kywT
Name (R)-5-IODO-4-OXO-2-PHENYL-3,4-DIHYDRO-2H-PYRIMIDINE-1(2H)-CARBOXYLIC-ACID-BENZYLESTER
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H15IN2O3
InChI InChI=1S/C18H15IN2O3/c19-15-11-21(18(23)24-12-13-7-3-1-4-8-13)16(20-17(15)22)14-9-5-2-6-10-14/h1-11,16H,12H2,(H,20,22)/t16-/m1/s1
InChIKey DGOMTWNFAMVTRQ-MRXNPFEDSA-N
Literature Reference Author M.NAHEWOLD,A.STONCIUS,A.PENNER,B.NEUMANN,H.G.STAMMLER,N.SEWA LD
Literature Reference Citation BEIL.J.ORG.CHEM.,5,43,1(2009)
Molecular Weight 434.233 g/mol
Solvent DMSO-D6
Source File Reference UWBT10453