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1-(2'-PYRROLIDINETHION-3'-YL)-1,2,3,4-TETRAHYDRO-BETA-CARBOLINE-3-CARBOXYLIC-ACID
SpectraBase Compound ID DPtNbokb8LF
InChI InChI=1S/C16H17N3O2S/c20-16(21)12-7-10-8-3-1-2-4-11(8)18-14(10)13(19-12)9-5-6-17-15(9)22/h1-4,9,12-13,18-19H,5-7H2,(H,17,22)(H,20,21)
InChIKey YHAYSIGUKKXZJH-UHFFFAOYSA-N
Mol Weight 315.39 g/mol
Molecular Formula C16H17N3O2S
Exact Mass 315.104148 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CwyVD9j4504
Name 1-(2'-PYRROLIDINETHION-3'-YL)-1,2,3,4-TETRAHYDRO-BETA-CARBOLINE-3-CARBOXYLIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17N3O2S
InChI InChI=1S/C16H17N3O2S/c20-16(21)12-7-10-8-3-1-2-4-11(8)18-14(10)13(19-12)9-5-6-17-15(9)22/h1-4,9,12-13,18-19H,5-7H2,(H,17,22)(H,20,21)
InChIKey YHAYSIGUKKXZJH-UHFFFAOYSA-N
Literature Reference Author Y.OZAWA,S.KAWAKISHI,Y.UDA,Y.MAEDA
Literature Reference Citation AGR.BIOL.CHEM.,54,1241(1990)
Literature Reference DOI 10.1271/bbb1961.54.1241
Molecular Weight 315.390 g/mol
Solvent DMSO-D6
Source File Reference UWBT7942