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CIS-2-(4-CHLOROPHENYL)-2-[4(1-METHYL-2-IMIDAZOLYL)-BUTYL]-4-(BENZOYLOXY-METHYL)-1,3-DIOXOLANE
SpectraBase Compound ID IBjXnfkNENP
InChI InChI=1S/C25H27ClN2O4/c1-28-16-15-27-23(28)9-5-6-14-25(20-10-12-21(26)13-11-20)31-18-22(32-25)17-30-24(29)19-7-3-2-4-8-19/h2-4,7-8,10-13,15-16,22H,5-6,9,14,17-18H2,1H3/t22-,25-/m0/s1
InChIKey ZKRMKQCHJZKQSG-DHLKQENFSA-N
Mol Weight 454.95 g/mol
Molecular Formula C25H27ClN2O4
Exact Mass 454.165935 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7k2tF4OojQ2
Name CIS-2-(4-CHLOROPHENYL)-2-[4(1-METHYL-2-IMIDAZOLYL)-BUTYL]-4-(BENZOYLOXY-METHYL)-1,3-DIOXOLANE
Compound Number 21 B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H27ClN2O4
InChI InChI=1S/C25H27ClN2O4/c1-28-16-15-27-23(28)9-5-6-14-25(20-10-12-21(26)13-11-20)31-18-22(32-25)17-30-24(29)19-7-3-2-4-8-19/h2-4,7-8,10-13,15-16,22H,5-6,9,14,17-18H2,1H3/t22-,25-/m0/s1
InChIKey ZKRMKQCHJZKQSG-DHLKQENFSA-N
Literature Reference Author L.F.HUANG,L.BAUER
Literature Reference Citation J.HETCYCL.CHEM.,34,1123(1997)
Literature Reference DOI 10.1002/jhet.5570340405
Molecular Weight 454.953 g/mol
Solvent CDCl3
Source File Reference UWSW790