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

*Links on SpectraBase are not permalinks.
N-CHLORAMBUCIL-META-HYDROXYPHENYL-L-PARA-TYROSINAMIDE
SpectraBase Compound ID B0YVvdGoAWu
InChI InChI=1S/C29H33Cl2N3O4/c30-15-17-34(18-16-31)24-11-7-21(8-12-24)3-1-6-28(37)33-27(19-22-9-13-25(35)14-10-22)29(38)32-23-4-2-5-26(36)20-23/h2,4-5,7-14,20,27,35-36H,1,3,6,15-19H2,(H,32,38)(H,33,37)/t27-/m0/s1
InChIKey UKHKSOPUZBNTPE-MHZLTWQESA-N
Mol Weight 558.5 g/mol
Molecular Formula C29H33Cl2N3O4
Exact Mass 557.184812 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 5FEOeUNimA2
Name N-CHLORAMBUCIL-META-HYDROXYPHENYL-L-PARA-TYROSINAMIDE
Compound Number 5-(MADE-WITH-META-HYDROXYANILINE)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H33Cl2N3O4
InChI InChI=1S/C29H33Cl2N3O4/c30-15-17-34(18-16-31)24-11-7-21(8-12-24)3-1-6-28(37)33-27(19-22-9-13-25(35)14-10-22)29(38)32-23-4-2-5-26(36)20-23/h2,4-5,7-14,20,27,35-36H,1,3,6,15-19H2,(H,32,38)(H,33,37)/t27-/m0/s1
InChIKey UKHKSOPUZBNTPE-MHZLTWQESA-N
Literature Reference Author C.DESCOTEAUX,K.BRASSEUR,V.LEBLANC,S.PARENT,E.ASSELIN,G.BERUB E
Literature Reference Citation STEROIDS,77,403(2012)
Literature Reference DOI 10.1016/j.steroids.2011.12.021
Molecular Weight 558.505 g/mol
Sample ID 70568
Solvent ACETONE-D6