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5-AMINO-1-[(1-alpha,2-beta,3-alpha)-2,3-BIS-(BENZOYLOXY-METHYL)-CYCLOBUTYL]-4-(CYANOFORMIDOYL)-IMIDAZOLE

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5-AMINO-1-[(1-alpha,2-beta,3-alpha)-2,3-BIS-(BENZOYLOXY-METHYL)-CYCLOBUTYL]-4-(CYANOFORMIDOYL)-IMIDAZOLE
SpectraBase Compound ID 80YJWGrRHDS
InChI InChI=1S/C25H23N5O4/c26-12-20(27)22-23(28)30(15-29-22)21-11-18(13-33-24(31)16-7-3-1-4-8-16)19(21)14-34-25(32)17-9-5-2-6-10-17/h1-10,15,18-19,21,27H,11,13-14,28H2/t18-,19-,21-/m0/s1
InChIKey DWTZPVCJULXBLL-ZJOUEHCJSA-N
Mol Weight 457.49 g/mol
Molecular Formula C25H23N5O4
Exact Mass 457.175004 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D5c6fkUprEu
Name 5-AMINO-1-[(1-alpha,2-beta,3-alpha)-2,3-BIS-(BENZOYLOXY-METHYL)-CYCLOBUTYL]-4-(CYANOFORMIDOYL)-IMIDAZOLE
Compound Number 20
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H23N5O4/c26-12-20(27)22-23(28)30(15-29-22)21-11-18(13-33-24(31)16-7-3-1-4-8-16)19(21)14-34-25(32)17-9-5-2-6-10-17/h1-10,15,18-19,21,27H,11,13-14,28H2/t18-,19-,21-/m0/s1
InChIKey DWTZPVCJULXBLL-ZJOUEHCJSA-N
Literature Reference B.L.BOOTH,P.R.EASTWOOD J.CHEM.SOC.PERKIN-1,669(1995)
Solvent Dimethyl sulfoxide-d6