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ZSCMXKJLOJXDTG-VZSBHQKLSA-L
SpectraBase Compound ID 1DhvXaBD13B
InChI InChI=1S/C16H28N2.2HI/c1-3-7-17-11-14-9-13(15(17)5-1)10-18(12-17)8-4-2-6-16(14)18;;/h13-16H,1-12H2;2*1H/q+2;;/p-2/t13-,14-,15-,16+,17+,18+;;/m0../s1
InChIKey ZSCMXKJLOJXDTG-VZSBHQKLSA-L
Mol Weight 502.22295 g/mol
Molecular Formula C16H28I2N2
Exact Mass 502.034189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3odadPqntEQ
Name ZSCMXKJLOJXDTG-VZSBHQKLSA-L
Compound Number (A-3).2J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H28I2N2
InChI InChI=1S/C16H28N2.2HI/c1-3-7-17-11-14-9-13(15(17)5-1)10-18(12-17)8-4-2-6-16(14)18;;/h13-16H,1-12H2;2*1H/q+2;;/p-2/t13-,14-,15-,16+,17+,18+;;/m0../s1
InChIKey ZSCMXKJLOJXDTG-VZSBHQKLSA-L
Literature Reference Author B.MIKHOVA,H.DUDDECK
Literature Reference Citation MAGN.RES.CHEM.,36,779(1998)
Literature Reference DOI 10.1002/(sici)1097-458x(1998110)36:11<779::aid-omr374>3.3.co;2-r
Molecular Weight 502.221 g/mol
Solvent D2O
Source File Reference UWBS557