John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=EoEKvaRan2f SpectraBase Spectrum ID=55rC0SOIIiU

(accessed ).
N-[4-CHLORO-7-[(S)-4-OXOAZETIDIN-2-YLMETHY]-7H-PYRRPLO-[2,3-D]-PYRIMIDIN-2-YL]-2,2-DIMETHYLPROPIONAMIDE
SpectraBase Compound ID EoEKvaRan2f
InChI InChI=1S/C15H18ClN5O2/c1-15(2,3)13(23)20-14-18-11(16)9-4-5-21(12(9)19-14)7-8-6-10(22)17-8/h4-5,8H,6-7H2,1-3H3,(H,17,22)(H,18,19,20,23)/t8-/m0/s1
InChIKey CFGQJKLOQPZUBU-QMMMGPOBSA-N
Mol Weight 335.8 g/mol
Molecular Formula C15H18ClN5O2
Exact Mass 335.114903 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 55rC0SOIIiU
Name N-[4-CHLORO-7-[(S)-4-OXOAZETIDIN-2-YLMETHY]-7H-PYRRPLO-[2,3-D]-PYRIMIDIN-2-YL]-2,2-DIMETHYLPROPIONAMIDE
Compound Number 7
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H18ClN5O2
InChI InChI=1S/C15H18ClN5O2/c1-15(2,3)13(23)20-14-18-11(16)9-4-5-21(12(9)19-14)7-8-6-10(22)17-8/h4-5,8H,6-7H2,1-3H3,(H,17,22)(H,18,19,20,23)/t8-/m0/s1
InChIKey CFGQJKLOQPZUBU-QMMMGPOBSA-N
Literature Reference Author P.CHAKRABORTY,A.M.BRUECKNER,U.DIEDERICHSEN
Literature Reference Citation EUR.J.ORG.CHEM.,2410(2006)
Molecular Weight 335.793 g/mol
Sample ID 44932
Solvent DMSO-D6
SpectraBase Batch ID 9O6N4qVpDSs