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SECURAMINE-B

View entire compound with spectra: 1 NMR

SECURAMINE-B
SpectraBase Compound ID 6yGKUzkrZ7p
InChI InChI=1S/C20H19Br2ClN4O/c1-19(2)15(23)9-20-12(11-4-3-10(21)7-14(11)26-20)8-16(28)27(20)6-5-13-17(19)25-18(22)24-13/h3-7,12,15,26H,8-9H2,1-2H3,(H,24,25)/b6-5-/t12-,15+,20-/m1/s1
InChIKey XRFAXSYCYALISO-RFCQJWROSA-N
Mol Weight 526.66 g/mol
Molecular Formula C20H19Br2ClN4O
Exact Mass 523.961415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FtgP1Mhzv4E
Name SECURAMINE-B
Compound Number 61
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H19Br2ClN4O
InChI InChI=1S/C20H19Br2ClN4O/c1-19(2)15(23)9-20-12(11-4-3-10(21)7-14(11)26-20)8-16(28)27(20)6-5-13-17(19)25-18(22)24-13/h3-7,12,15,26H,8-9H2,1-2H3,(H,24,25)/b6-5-/t12-,15+,20-/m1/s1
InChIKey XRFAXSYCYALISO-RFCQJWROSA-N
Literature Reference Author P.M.PAULETTI,L.S.CINTRA,C.G.BRAGUINE,A.A.D.S.FILHO,M.L.A.E.S ILVA,W.R.CUNHA
Literature Reference Citation MAR.DRUGS,8,1526(2010)
Literature Reference DOI 10.3390/md8051526
Molecular Weight 526.658 g/mol
Source File Reference UWIR6255