John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=17O4SBmi51X SpectraBase Spectrum ID=2v6VfDIIzFn

(accessed ).
2-(AMINOACETYLAMINO)-ACETIC-ACID-[3-(1,3-DIHYDRO-1,3-DIOXO-2H-ISOINDOLE-2-YL)-2,6-DIOXO-PIPERIDINE-1-YL-METHYL]-ESTER-HCL
SpectraBase Compound ID 17O4SBmi51X
InChI InChI=1S/C18H18N4O7.ClH/c19-7-13(23)20-8-15(25)29-9-21-14(24)6-5-12(18(21)28)22-16(26)10-3-1-2-4-11(10)17(22)27;/h1-4,12H,5-9,19H2,(H,20,23);1H
InChIKey SQFZKWAIUNAZCD-UHFFFAOYSA-N
Mol Weight 438.82 g/mol
Molecular Formula C18H19ClN4O7
Exact Mass 438.094227 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2v6VfDIIzFn
Name 2-(AMINOACETYLAMINO)-ACETIC-ACID-[3-(1,3-DIHYDRO-1,3-DIOXO-2H-ISOINDOLE-2-YL)-2,6-DIOXO-PIPERIDINE-1-YL-METHYL]-ESTER-HCL
Compound Number 10
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H19ClN4O7
InChI InChI=1S/C18H18N4O7.ClH/c19-7-13(23)20-8-15(25)29-9-21-14(24)6-5-12(18(21)28)22-16(26)10-3-1-2-4-11(10)17(22)27;/h1-4,12H,5-9,19H2,(H,20,23);1H
InChIKey SQFZKWAIUNAZCD-UHFFFAOYSA-N
Literature Reference Author S.HESS,M.A.AKERMANN,S.WNENDT,K.ZWINGENBERGER,K.EGER
Literature Reference Citation BIOORG.MED.CHEM.,9,1279(2001)
Literature Reference DOI 10.1016/S0968-0896(00)00342-4
Molecular Weight 438.824 g/mol
Solvent D2O
Source File Reference UWMS21908
SpectraBase Batch ID 74olqequWGg