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OPACALINE_A

View entire compound with spectra: 2 NMR

OPACALINE_A
SpectraBase Compound ID Jrgi8h9KYHZ
InChI InChI=1S/C16H18BrN5/c17-10-4-5-11-12-6-8-20-13(15(12)22-14(11)9-10)3-1-2-7-21-16(18)19/h4-6,8-9,22H,1-3,7H2,(H4,18,19,21)/p+2
InChIKey RYDDJEFQYPXRAF-UHFFFAOYSA-P
Mol Weight 362.28 g/mol
Molecular Formula C16H20BrN5
Exact Mass 361.090209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 44wAEuGvHex
Name OPACALINE_A
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20BrN5
InChI InChI=1S/C16H18BrN5/c17-10-4-5-11-12-6-8-20-13(15(12)22-14(11)9-10)3-1-2-7-21-16(18)19/h4-6,8-9,22H,1-3,7H2,(H4,18,19,21)/p+2
InChIKey RYDDJEFQYPXRAF-UHFFFAOYSA-P
Literature Reference Author S.T.S.CHAN,A.N.PEARCE,M.J.PAGE,M.KAISER,B.R.COPP
Literature Reference Citation J.NAT.PROD.,74,1972(2011)
Literature Reference DOI 10.1021/np200509g
Molecular Weight 362.272 g/mol
Sample ID 39253
Solvent CD3OD