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Hemibastadin-2

View entire compound with spectra: 1 NMR

Hemibastadin-2
SpectraBase Compound ID EA35vq8eKf9
InChI InChI=1S/C17H15Br3N2O4/c18-11-5-9(1-2-15(11)23)3-4-21-17(25)14(22-26)8-10-6-12(19)16(24)13(20)7-10/h1-2,5-7,23-24,26H,3-4,8H2,(H,21,25)/b22-14-
InChIKey QFAQAERRJYHBMR-HMAPJEAMSA-N
Mol Weight 551.03 g/mol
Molecular Formula C17H15Br3N2O4
Exact Mass 547.858196 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7tjlPXiVDHQ
Name HEMIBASTADIN-2
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H14Br3N2O4
InChI InChI=1S/C17H15Br3N2O4/c18-11-5-9(1-2-15(11)23)3-4-21-17(25)14(22-26)8-10-6-12(19)16(24)13(20)7-10/h1-2,5-7,23-24,26H,3-4,8H2,(H,21,25)/b22-14-
InChIKey QFAQAERRJYHBMR-HMAPJEAMSA-N
Literature Reference Author G.R.PETTIT,M.S.BUTLER,M.D.WILLIAMS,M.J.FILIATRAULT,R.K.PETIT
Literature Reference Citation J.NAT.PROD.,59,927(1996)
Literature Reference DOI 10.1021/np960249n
Molecular Weight 550.021 g/mol
Solvent CD3OD
Source File Reference UWVP723