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1,3-BIS-[2-(4,5-DIHYDRO)-IMIDAZOLYLAMINOMETHYL]-BENZENE

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1,3-BIS-[2-(4,5-DIHYDRO)-IMIDAZOLYLAMINOMETHYL]-BENZENE
SpectraBase Compound ID 199jpNhRVOD
InChI InChI=1S/C14H20N6.2HI/c1-2-11(9-19-13-15-4-5-16-13)8-12(3-1)10-20-14-17-6-7-18-14;;/h1-3,8H,4-7,9-10H2,(H2,15,16,19)(H2,17,18,20);2*1H
InChIKey ACNKDJBCAHGOBL-UHFFFAOYSA-N
Mol Weight 528.181 g/mol
Molecular Formula C14H22I2N6
Exact Mass 527.999535 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7cr7hTmPWMe
Name 1,3-BIS-[2-(4,5-DIHYDRO)-IMIDAZOLYLAMINOMETHYL]-BENZENE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H22I2N6
InChI InChI=1S/C14H20N6.2HI/c1-2-11(9-19-13-15-4-5-16-13)8-12(3-1)10-20-14-17-6-7-18-14;;/h1-3,8H,4-7,9-10H2,(H2,15,16,19)(H2,17,18,20);2*1H
InChIKey ACNKDJBCAHGOBL-UHFFFAOYSA-N
Literature Reference Author H.H.ZEPIK,S.A.BENNER
Literature Reference Citation J.ORG.CHEM.,64,8080(1999)
Literature Reference DOI 10.1021/jo982418+
Molecular Weight 528.178 g/mol
Sample ID 40408
Solvent DMSO-D6