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ZWEPUEMGPVWRNG-BKTGTZMESA-N

View entire compound with spectra: 1 NMR

ZWEPUEMGPVWRNG-BKTGTZMESA-N
SpectraBase Compound ID FRd68fmgBGX
InChI InChI=1S/C22H21ClO8/c1-27-16-4-10(5-17(28-2)21(16)29-3)18-11-6-14-15(31-9-30-14)7-12(11)20(24)13(8-23)19(18)22(25)26/h4-7,13,18-19H,8-9H2,1-3H3,(H,25,26)/t13-,18+,19-/m0/s1
InChIKey ZWEPUEMGPVWRNG-BKTGTZMESA-N
Mol Weight 448.86 g/mol
Molecular Formula C22H21ClO8
Exact Mass 448.092495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID zGU7h8LB8g
Name ZWEPUEMGPVWRNG-BKTGTZMESA-N
Compound Number 94
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H21ClO8
InChI InChI=1S/C22H21ClO8/c1-27-16-4-10(5-17(28-2)21(16)29-3)18-11-6-14-15(31-9-30-14)7-12(11)20(24)13(8-23)19(18)22(25)26/h4-7,13,18-19H,8-9H2,1-3H3,(H,25,26)/t13-,18+,19-/m0/s1
InChIKey ZWEPUEMGPVWRNG-BKTGTZMESA-N
Literature Reference Author A.SANFELICIANO,J.M.M.DELCORRAL,M.GORDALIZA,M.A.CASTRO
Literature Reference Citation MAGN.RES.CHEM.,31,868(1993)
Literature Reference DOI 10.1002/mrc.1260310915
Molecular Weight 448.857 g/mol
Solvent CDCl3
Source File Reference UWPR142