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MAURITIAMINE;NATURAL-PRODUCT
SpectraBase Compound ID 1I5ECmAPmwB
InChI InChI=1S/C22H20Br4N10O3.2C2HF3O2/c23-9-7-12(31-15(9)25)17(37)29-5-1-3-11-14(34-20(27)33-11)22(19(39)35-21(28)36-22)4-2-6-30-18(38)13-8-10(24)16(26)32-13;2*3-2(4,5)1(6)7/h1-4,7-8,31-32H,5-6H2,(H,29,37)(H,30,38)(H3,27,33,34)(H3,28,35,36,39);2*(H,6,7)/b3-1+,4-2+;;/t22-;;/m1../s1
InChIKey UEAARLSSKYAYDI-QSRFCXPSSA-N
Mol Weight 1020.131 g/mol
Molecular Formula C26H22Br4F6N10O7
Exact Mass 1015.831064 g/mol
Parent InChIKey AACKLUYHFHIQSO-OMVZTBPASA-N
Enantiomer InChIKey UEAARLSSKYAYDI-KMIGEAEBSA-N
Racemate InChIKey UEAARLSSKYAYDI-UFVDJLLLSA-N
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Solvent CD3OD
Title Journal or Book Year
Unusually Large 13C NMR Chemical Shift Differences between Neutral and Protonated Glycocyamidines. New Insights on Previously Reported Chemical Shift Assignments and Chemical Properties The Journal of Organic Chemistry 1998

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