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1-[1'-Acetamido-2'-(trimethylsilylmethylthio)ethyl]-6-bromo-2-hydroxy-1,2,3,4-tetrahydro-.beta.-carboline
SpectraBase Compound ID KW8ZHHVKy70
InChI InChI=1S/C19H28BrN3O2SSi/c1-12(24)21-17(10-26-11-27(2,3)4)19-18-14(7-8-23(19)25)15-9-13(20)5-6-16(15)22-18/h5-6,9,17,19,22,25H,7-8,10-11H2,1-4H3,(H,21,24)/t17-,19?/m1/s1
InChIKey OQQCMJNMZDXYCP-DUSLRRAJSA-N
Mol Weight 470.5 g/mol
Molecular Formula C19H28BrN3O2SSi
Exact Mass 469.085488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID c7mTJndLdt
Name 1-[1'-ACETAMIDO-2'-(TRIMETHYLSILYLMETHYLTHIO)-ETHYL]-6-BROMO-2-HYDROXY-1,2,3,4-TETRAHYDRO-BETA-CARBOLINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H27BrN3O2SSi
InChI InChI=1S/C19H28BrN3O2SSi/c1-12(24)21-17(10-26-11-27(2,3)4)19-18-14(7-8-23(19)25)15-9-13(20)5-6-16(15)22-18/h5-6,9,17,19,22,25H,7-8,10-11H2,1-4H3,(H,21,24)/t17-,19?/m1/s1
InChIKey OQQCMJNMZDXYCP-DUSLRRAJSA-N
Literature Reference Author I.W.J.STILL,J.R.STRAUTMANIS
Literature Reference Citation CAN.J.CHEM.,68,1408(1990)
Literature Reference DOI 10.1139/v90-216
Molecular Weight 469.492 g/mol
Solvent DMSO-D6
Source File Reference UWED10617