John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=502eydXlWYe SpectraBase Spectrum ID=3mfstmrXROz

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[ICH2CO(DH)2(PROPYLAMINE)]

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[ICH2CO(DH)2(PROPYLAMINE)]
SpectraBase Compound ID 502eydXlWYe
InChI InChI=1S/2C4H7N2O2.C3H8N.CH2I.Co/c2*1-3(5-7)4(2)6-8;1-2-3-4;1-2;/h2*7H,1-2H3;4H,2-3H2,1H3;1H2;/q;;-1;;+1
InChIKey NKFKKKGHOHIBAJ-UHFFFAOYSA-N
Mol Weight 486.18 g/mol
Molecular Formula C12H22CoIN5O4
Exact Mass 486.004854 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3mfstmrXROz
Name [ICH2CO(DH)2(PROPYLAMINE)]
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H22CoIN5O4
InChI InChI=1S/2C4H7N2O2.C3H8N.CH2I.Co/c2*1-3(5-7)4(2)6-8;1-2-3-4;1-2;/h2*7H,1-2H3;4H,2-3H2,1H3;1H2;/q;;-1;;+1
InChIKey NKFKKKGHOHIBAJ-UHFFFAOYSA-N
Literature Reference Author C.S.DEVI,P.NAGABABU,M.SHILPA,S.SATYANARAYANA
Literature Reference Citation J.CHEM.PHARM.RES.,2,6,369(2010)
Molecular Weight 486.175 g/mol
Solvent DMSO-D6
Source File Reference UWIR14262
SpectraBase Batch ID BTN41ErweSY