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ARCCBVHXHHINEZ-UHFFFAOYSA-N
SpectraBase Compound ID F5dRCrfKt34
InChI InChI=1S/C13H13Br2NO5/c1-21-13(20)7-2-3-9(18)16(7)5-6-4-8(17)12(19)11(15)10(6)14/h4,7,17,19H,2-3,5H2,1H3
InChIKey ARCCBVHXHHINEZ-UHFFFAOYSA-N
Mol Weight 423.06 g/mol
Molecular Formula C13H13Br2NO5
Exact Mass 420.916049 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DoSsj4IwB7z
Name N-(2,3-DIBROMO-4,5-DIHYDROXYBENZYL)-METHYL_PYROGLUTAMATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13Br2NO5
InChI InChI=1S/C13H13Br2NO5/c1-21-13(20)7-2-3-9(18)16(7)5-6-4-8(17)12(19)11(15)10(6)14/h4,7,17,19H,2-3,5H2,1H3
InChIKey ARCCBVHXHHINEZ-UHFFFAOYSA-N
Literature Reference Author J.ZHAO,M.MA,S.WANG,S.LI,P.CAO,Y.YANG,Y.LUE,J.SHI,N.JU,X.FAN, L.HE
Literature Reference Citation J.NAT.PROD.,68,691(2005)
Literature Reference DOI 10.1021/np040234m
Molecular Weight 423.058 g/mol
Solvent ACTONE-D6