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1-CHLOROMETHYL-5-HYDROXY-1,2-DIHYDRO-3-[(5-DIMETHYLSULFAMOYLOXY-1H-INDOL-2-YL)-CARBONYL]-INDOLINE
SpectraBase Compound ID 8MdI9GzP79j
InChI InChI=1S/C20H20ClN3O5S/c1-23(2)30(27,28)29-15-4-6-17-12(7-15)8-18(22-17)20(26)24-11-13(10-21)16-5-3-14(25)9-19(16)24/h3-9,13,22,25H,10-11H2,1-2H3
InChIKey DMSJYFRRWBDFIJ-UHFFFAOYSA-N
Mol Weight 449.91 g/mol
Molecular Formula C20H20ClN3O5S
Exact Mass 449.08122 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ARzxKoxLY9Q
Name 1-CHLOROMETHYL-5-HYDROXY-1,2-DIHYDRO-3-[(5-DIMETHYLSULFAMOYLOXY-1H-INDOL-2-YL)-CARBONYL]-INDOLINE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H20ClN3O5S
InChI InChI=1S/C20H20ClN3O5S/c1-23(2)30(27,28)29-15-4-6-17-12(7-15)8-18(22-17)20(26)24-11-13(10-21)16-5-3-14(25)9-19(16)24/h3-9,13,22,25H,10-11H2,1-2H3
InChIKey DMSJYFRRWBDFIJ-UHFFFAOYSA-N
Literature Reference Author T.CHOI,E.MA
Literature Reference Citation MOLECULES,15,7971(2010)
Literature Reference DOI 10.3390/molecules15117971
Molecular Weight 449.909 g/mol
Sample ID 72637
Solvent ACETONE-D6