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LAOXDEJNMFQMIZ-HYFSLMIVSA-M

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LAOXDEJNMFQMIZ-HYFSLMIVSA-M
SpectraBase Compound ID EXohshReZ28
InChI InChI=1S/C21H26NO3.BrH/c1-24-19-10-16-8-9-22(12-15-6-4-3-5-7-15)13-17(14-23)21(22)18(16)11-20(19)25-2;/h3-7,10-11,17,21,23H,8-9,12-14H2,1-2H3;1H/q+1;/p-1/t17-,21-,22+;/m1./s1
InChIKey LAOXDEJNMFQMIZ-HYFSLMIVSA-M
Mol Weight 420.35 g/mol
Molecular Formula C21H26BrNO3
Exact Mass 419.109607 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6hDuRO1ticl
Name LAOXDEJNMFQMIZ-HYFSLMIVSA-M
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26BrNO3
InChI InChI=1S/C21H26NO3.BrH/c1-24-19-10-16-8-9-22(12-15-6-4-3-5-7-15)13-17(14-23)21(22)18(16)11-20(19)25-2;/h3-7,10-11,17,21,23H,8-9,12-14H2,1-2H3;1H/q+1;/p-1/t17-,21-,22+;/m1./s1
InChIKey LAOXDEJNMFQMIZ-HYFSLMIVSA-M
Literature Reference Author G.BERNATH,F.FUELOEP,J.ARVA,J.KOBOR,P.SOHAR
Literature Reference Citation J.HETCYCL.CHEM.,28,353(1991)
Literature Reference DOI 10.1002/jhet.5570280228
Molecular Weight 420.346 g/mol
Solvent DMSO-D6
Source File Reference UWCS16959