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5-Iodo-4-methoxy-9-tosylaminopyrido[3',2':4,5]pyrrolo[1,2-c]pyrimidine
SpectraBase Compound ID 2TnlpILBbB4
InChI InChI=1S/C18H15IN4O3S/c1-11-3-5-12(6-4-11)27(24,25)22-18-21-9-7-13-16(19)15-14(26-2)8-10-20-17(15)23(13)18/h3-10H,1-2H3,(H,21,22)
InChIKey PVJHYETUEVUHPX-UHFFFAOYSA-N
Mol Weight 494.31 g/mol
Molecular Formula C18H15IN4O3S
Exact Mass 493.990957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G9TszXlyUmv
Name 5-IODO-4-METHOXY-9-TOSYLAMINOPYRIDO-[3',2':4,5]-PYRROLO-[1,2-C]-PYRIMIDINE
Compound Number 26B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H15IN4O3S
InChI InChI=1S/C18H15IN4O3S/c1-11-3-5-12(6-4-11)27(24,25)22-18-21-9-7-13-16(19)15-14(26-2)8-10-20-17(15)23(13)18/h3-10H,1-2H3,(H,21,22)
InChIKey PVJHYETUEVUHPX-UHFFFAOYSA-N
Literature Reference Author A.AHAIDAR,D.FERNANDEZ,G.DANELON,C.CUEVAS,I.MANZANARES,F.ALBE RICIO,J.A.JOULE,M.AL
Literature Reference Citation J.ORG.CHEM.,68,10020(2003)
Literature Reference DOI 10.1021/jo035332b
Molecular Weight 494.307 g/mol
Solvent DMSO-D6
Source File Reference UWLU28459