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N-[(5-S,10-R)-7,9-DIBROMO-10-HYDROXY-8-METHOXY-1-OXA-2-AZASPIRO-[4.5]-DECA-2,6,8-TRIENE-3-CARBONYL]-4-AMINOBUTANOIC_ACID
SpectraBase Compound ID F84y3gpMIv9
InChI InChI=1S/C14H16Br2N2O6/c1-23-11-7(15)5-14(12(21)10(11)16)6-8(18-24-14)13(22)17-4-2-3-9(19)20/h5,12,21H,2-4,6H2,1H3,(H,17,22)(H,19,20)/t12-,14+/m0/s1
InChIKey QIRBPXLEOLCMDX-GXTWGEPZSA-N
Mol Weight 468.1 g/mol
Molecular Formula C14H16Br2N2O6
Exact Mass 465.937512 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KT93CGh0cnk
Name N-[(5S,10R)-7,9-DIBROMO-10-HYDROXY-8-METHOXY-1-OXA-2-AZASPIRO-[4.5]-DECA-2,6,8-TRIENE-3-CARBOXY]-4-AMINOBUTANOIC-ACID
Compound Number 74
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16Br2N2O6
InChI InChI=1S/C14H16Br2N2O6/c1-23-11-7(15)5-14(12(21)10(11)16)6-8(18-24-14)13(22)17-4-2-3-9(19)20/h5,12,21H,2-4,6H2,1H3,(H,17,22)(H,19,20)/t12-,14+/m0/s1
InChIKey QIRBPXLEOLCMDX-GXTWGEPZSA-N
Literature Reference Author N.S.LIRA,R.C.MONTES,J.F.TAVARES,M.S.D.SILVA,E.V.L.D.CUNHA,P. F.D.ATHAYDE-FILHO
Literature Reference Citation MAR.DRUGS,9,2316(2011)
Literature Reference DOI 10.3390/md9112316
Molecular Weight 468.099 g/mol
Source File Reference UWBT6942