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(-)-(1R,7aS)-2-(2-(hydroxydiphenylmethyl)phenyl)-1-isopropoxytetrahydro-1Hpyrrolo[1,2-c]imidazol-3(2H)-one
SpectraBase Compound ID 2aoiUM0sYcs
InChI InChI=1S/C28H30N2O3/c1-20(2)33-26-25-18-11-19-29(25)27(31)30(26)24-17-10-9-16-23(24)28(32,21-12-5-3-6-13-21)22-14-7-4-8-15-22/h3-10,12-17,20,25-26,32H,11,18-19H2,1-2H3/t25-,26+/m0/s1
InChIKey HCLSUNAVGYDGDE-IZZNHLLZSA-N
Mol Weight 442.56 g/mol
Molecular Formula C28H30N2O3
Exact Mass 442.225643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6ZuI4gB7tD
Name (-)-(1R,7aS)-2-(2-(hydroxydiphenylmethyl)phenyl)-1-isopropoxytetrahydro-1Hpyrrolo[1,2-c]imidazol-3(2H)-one
Alternate Name(s) (1R,7aS)-2-(2-(hydroxydiphenylmethyl)phenyl)-1-isopropoxyhexahydro-3H-pyrrolo[1,2-c]imidazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H30N2O3
InChI InChI=1S/C28H30N2O3/c1-20(2)33-26-25-18-11-19-29(25)27(31)30(26)24-17-10-9-16-23(24)28(32,21-12-5-3-6-13-21)22-14-7-4-8-15-22/h3-10,12-17,20,25-26,32H,11,18-19H2,1-2H3/t25-,26+/m0/s1
InChIKey HCLSUNAVGYDGDE-IZZNHLLZSA-N
Literature Reference DOI 10.1002/adsc.201600369
Molecular Weight 442.559 g/mol
SMILES OC(c1ccccc1N1C(N2[C@]([C@]1(OC(C)C)[H])(CCC2)[H])=O)(c1ccccc1)c1ccccc1
SPLASH splash10-0kas-0289000000-94d237fbe93636cdfbd1
Source of Spectrum ASC-358-2599/SM7-16
Wiley ID 1807524