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3,3'-(DODECANE-1,12-DIYL)-BIS-[5-(PYRROLIDIN-1-YL-METHYL)-IMIDAZOLIDINE-2,4-DIONE]-DIHYDROCHLORIDE
SpectraBase Compound ID JWfk5LYgYKy
InChI InChI=1S/C28H48N6O4.2ClH/c35-25-23(21-31-15-11-12-16-31)29-27(37)33(25)19-9-7-5-3-1-2-4-6-8-10-20-34-26(36)24(30-28(34)38)22-32-17-13-14-18-32;;/h23-24H,1-22H2,(H,29,37)(H,30,38);2*1H
InChIKey ZSXVTTAMUMDVQM-UHFFFAOYSA-N
Mol Weight 605.65 g/mol
Molecular Formula C28H50Cl2N6O4
Exact Mass 604.32706 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HVgx6FrBo3O
Name 3,3'-(DODECANE-1,12-DIYL)-BIS-[5-(PYRROLIDIN-1-YL-METHYL)-IMIDAZOLIDINE-2,4-DIONE]-DIHYDROCHLORIDE
Compound Number 22A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H50Cl2N6O4
InChI InChI=1S/C28H48N6O4.2ClH/c35-25-23(21-31-15-11-12-16-31)29-27(37)33(25)19-9-7-5-3-1-2-4-6-8-10-20-34-26(36)24(30-28(34)38)22-32-17-13-14-18-32;;/h23-24H,1-22H2,(H,29,37)(H,30,38);2*1H
InChIKey ZSXVTTAMUMDVQM-UHFFFAOYSA-N
Literature Reference Author F.FUJISAKI,H.AKI,A.NAITO,E.FUKAMI,N.KASHIGE,F.MIAKE,K.SUMOTO
Literature Reference Citation CHEM.PHARM.BULL.,62,429(2014)
Literature Reference DOI 10.1248/cpb.c14-00017
Molecular Weight 605.649 g/mol
Solvent DMSO-D6
Source File Reference UWBT13876