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UACDRDAOJDLEER-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

UACDRDAOJDLEER-UHFFFAOYSA-N
SpectraBase Compound ID CShYh92aTX9
InChI InChI=1S/C21H16N2O3.ClHO4/c1-25-21(24)15-5-3-2-4-14(15)20-16-8-6-12(22)10-18(16)26-19-11-13(23)7-9-17(19)20;2-1(3,4)5/h2-11,22H,23H2,1H3;(H,2,3,4,5)
InChIKey UACDRDAOJDLEER-UHFFFAOYSA-N
Mol Weight 444.83 g/mol
Molecular Formula C21H17ClN2O7
Exact Mass 444.072429 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ITN0ryYLXzm
Name UACDRDAOJDLEER-UHFFFAOYSA-N
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H17ClN2O7
InChI InChI=1S/C21H16N2O3.ClHO4/c1-25-21(24)15-5-3-2-4-14(15)20-16-8-6-12(22)10-18(16)26-19-11-13(23)7-9-17(19)20;2-1(3,4)5/h2-11,22H,23H2,1H3;(H,2,3,4,5)
InChIKey UACDRDAOJDLEER-UHFFFAOYSA-N
Literature Reference Author S.S.RAMOS,A.F.VILHENA,L.SANTOS,P.ALMEIDA
Literature Reference Citation MAGN.RES.CHEM.,38,475(2000)
Literature Reference DOI 10.1002/1097-458x(200006)38:6<475::aid-mrc662>3.0.co;2-x
Molecular Weight 444.828 g/mol
Solvent CDCl3+1_DROP_DMSO-D6