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3-[3-(2,6-dimethoxybenzoyl)imidazol-4-yl]-2-(9H-fluoren-9-ylmethoxycarbonylamino)propionic acid
SpectraBase Compound ID JiSL8FRIdzQ
InChI InChI=1S/C30H27N3O7/c1-38-25-12-7-13-26(39-2)27(25)28(34)33-17-31-15-18(33)14-24(29(35)36)32-30(37)40-16-23-21-10-5-3-8-19(21)20-9-4-6-11-22(20)23/h3-13,15,17,23-24H,14,16H2,1-2H3,(H,32,37)(H,35,36)
InChIKey HSOQVRKVUURQPE-UHFFFAOYSA-N
Mol Weight 541.56 g/mol
Molecular Formula C30H27N3O7
Exact Mass 541.1849 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DLGMOnHxpPc
Name 3-[3-(2,6-dimethoxybenzoyl)imidazol-4-yl]-2-(9H-fluoren-9-ylmethoxycarbonylamino)propionic acid
CAS Registry Number 602297-70-1
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H27N3O7
InChI InChI=1S/C30H27N3O7/c1-38-25-12-7-13-26(39-2)27(25)28(34)33-17-31-15-18(33)14-24(29(35)36)32-30(37)40-16-23-21-10-5-3-8-19(21)20-9-4-6-11-22(20)23/h3-13,15,17,23-24H,14,16H2,1-2H3,(H,32,37)(H,35,36)
InChIKey HSOQVRKVUURQPE-UHFFFAOYSA-N
Literature Reference Author S.ZARAMELLA,P.HEINONEN,E.YEHESKIELY,R.STROEMBERG
Literature Reference Citation J.ORG.CHEM.,68,7521(2003)
Literature Reference DOI 10.1021/jo0347967
Solvent DMSO-D6
Source File Reference UWLU27346