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#4.2HCL;(+/-)-(1RS,2RS,3SR,4SR,5SR)-5-EXO-AMINO-7-AZABICYCLO-[2.2.1]-HEPTANE-2,3-EXO-DIOL-DIHYDROCHLORIDE;(1RS,2RS,3SR,4SR,5SR)-5-AMMONIO-2,3-DIHYDROXY-
SpectraBase Compound ID 8a1tZpu34cR
InChI InChI=1S/C6H12N2O2.2ClH/c7-2-1-3-5(9)6(10)4(2)8-3;;/h2-6,8-10H,1,7H2;2*1H/t2-,3-,4+,5+,6-;;/m0../s1
InChIKey TWUGVQLTRMQZNY-CRDIGYIMSA-N
Mol Weight 217.1 g/mol
Molecular Formula C6H14Cl2N2O2
Exact Mass 216.043233 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2pfem2Gr55S
Name #4.2HCL;(+/-)-(1RS,2RS,3SR,4SR,5SR)-5-EXO-AMINO-7-AZABICYCLO-[2.2.1]-HEPTANE-2,3-EXO-DIOL-DIHYDROCHLORIDE;(1RS,2RS,3SR,4SR,5SR)-5-AMMONIO-2,3-DIHYDROXY-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H14Cl2N2O2
InChI InChI=1S/C6H12N2O2.2ClH/c7-2-1-3-5(9)6(10)4(2)8-3;;/h2-6,8-10H,1,7H2;2*1H/t2-,3-,4+,5+,6-;;/m0../s1
InChIKey TWUGVQLTRMQZNY-CRDIGYIMSA-N
Literature Reference Author A.J.M.VARGAS,C.SCHUETZ,R.SCOPELLITI,P.VOGEL
Literature Reference Citation J.ORG.CHEM.,68,5632(2003)
Literature Reference DOI 10.1021/jo0301088
Molecular Weight 217.095 g/mol
Solvent CD3OD
Source File Reference UWLU24230