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CIS-2-(4-CHLOROPHENYL)-2-(2-IMIDAZOLYLMETHYL)-4-(BENZOYLOXYMETHYL)-1,3-DIOXOLANE
SpectraBase Compound ID 8tmix9doBhN
InChI InChI=1S/C21H19ClN2O4/c22-17-8-6-16(7-9-17)21(12-19-23-10-11-24-19)27-14-18(28-21)13-26-20(25)15-4-2-1-3-5-15/h1-11,18H,12-14H2,(H,23,24)/t18-,21-/m0/s1
InChIKey DWEGANLZJKFXJN-RXVVDRJESA-N
Mol Weight 398.85 g/mol
Molecular Formula C21H19ClN2O4
Exact Mass 398.103335 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9EmCRpn6KZX
Name CIS-2-(4-CHLOROPHENYL)-2-(2-IMIDAZOLYLMETHYL)-4-(BENZOYLOXYMETHYL)-1,3-DIOXOLANE
Compound Number 31A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H19ClN2O4
InChI InChI=1S/C21H19ClN2O4/c22-17-8-6-16(7-9-17)21(12-19-23-10-11-24-19)27-14-18(28-21)13-26-20(25)15-4-2-1-3-5-15/h1-11,18H,12-14H2,(H,23,24)/t18-,21-/m0/s1
InChIKey DWEGANLZJKFXJN-RXVVDRJESA-N
Literature Reference Author J.W.KIM,F.S.DAVIS,L.F.HUANG,S.M.ABDELAAL,S.P.UPADHYAYA,J.J.L EE,L.BAUER
Literature Reference Citation J.HETCYCL.CHEM.,33,65(1996)
Literature Reference DOI 10.1002/jhet.5570330112
Molecular Weight 398.846 g/mol
Solvent CDCl3
Source File Reference UWCS20798