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2-CYANOMETHYLTETRAHYDRO-BETA-CARBOLINE;2-CM-THBC
SpectraBase Compound ID 2de6OfLrVX8
InChI InChI=1S/C13H13N3/c14-6-8-16-7-5-11-10-3-1-2-4-12(10)15-13(11)9-16/h1-4,15H,5,7-9H2
InChIKey GCJJXTGBRQUEFH-UHFFFAOYSA-N
Mol Weight 211.27 g/mol
Molecular Formula C13H13N3
Exact Mass 211.110947 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GoO73vHjuK1
Name 2-CYANOMETHYLTETRAHYDRO-BETA-CARBOLINE;2-CM-THBC
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13N3
InChI InChI=1S/C13H13N3/c14-6-8-16-7-5-11-10-3-1-2-4-12(10)15-13(11)9-16/h1-4,15H,5,7-9H2
InChIKey GCJJXTGBRQUEFH-UHFFFAOYSA-N
Literature Reference Author S.D.BRANDT,S.A.MOORE,S.FREEMAN,A.B.KANU
Literature Reference Citation DRUG.TEST.ANAL.,2,330(2010)
Literature Reference DOI 10.1002/dta.142
Molecular Weight 211.266 g/mol
Sample ID 72210
Solvent DMSO-D6