For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-AMINO-3-METHYL-BUTYRIC-ACID-[3-(1,3-DIHYDRO-1,3-DIOXO-2H-ISOINDOLE-2-YL)-2,6-DIOXO-PIPERIDINE-1-YL-METHYL]-ESTER-HCL
SpectraBase Compound ID 1kBXTCAF9ev
InChI InChI=1S/2C19H21N3O6.2ClH/c2*1-10(2)15(20)19(27)28-9-21-14(23)8-7-13(18(21)26)22-16(24)11-5-3-4-6-12(11)17(22)25;;/h2*3-6,10,13,15H,7-9,20H2,1-2H3;2*1H/t2*13?,15-;;/m00../s1
InChIKey BGOUDSCXNHNJQI-JVJMGOKPSA-N
Mol Weight 847.71 g/mol
Molecular Formula C38H44Cl2N6O12
Exact Mass 846.239426 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID F09HoYQD77E
Name 2-AMINO-3-METHYL-BUTYRIC-ACID-[3-(1,3-DIHYDRO-1,3-DIOXO-2H-ISOINDOLE-2-YL)-2,6-DIOXO-PIPERIDINE-1-YL-METHYL]-ESTER-HCL
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H44Cl2N6O12
InChI InChI=1S/2C19H21N3O6.2ClH/c2*1-10(2)15(20)19(27)28-9-21-14(23)8-7-13(18(21)26)22-16(24)11-5-3-4-6-12(11)17(22)25;;/h2*3-6,10,13,15H,7-9,20H2,1-2H3;2*1H/t2*13?,15-;;/m00../s1
InChIKey BGOUDSCXNHNJQI-JVJMGOKPSA-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 847.706 g/mol
Solvent DMSO-D6
Source File Reference UWMS21907