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(4aR,9bR)-2,8-dimethyl-5-propionyl-2,3,4,4a,5,9b-hexahydro-1H-pyrido[4,3-b]indol-2-ium chloride
SpectraBase Compound ID 1T69tqV9iWZ
InChI InChI=1S/C16H22N2O.ClH/c1-4-16(19)18-14-6-5-11(2)9-12(14)13-10-17(3)8-7-15(13)18;/h5-6,9,13,15H,4,7-8,10H2,1-3H3;1H
InChIKey RRUWRVZNYBNYSS-UHFFFAOYSA-N
Mol Weight 294.83 g/mol
Molecular Formula C16H23ClN2O
Exact Mass 294.149891 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 89aGgYUA48f
Name (4aR,9bR)-2,8-dimethyl-5-propionyl-2,3,4,4a,5,9b-hexahydro-1H-pyrido[4,3-b]indol-2-ium chloride
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H22N2O.ClH/c1-4-16(19)18-14-6-5-11(2)9-12(14)13-10-17(3)8-7-15(13)18;/h5-6,9,13,15H,4,7-8,10H2,1-3H3;1H
InChIKey RRUWRVZNYBNYSS-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_335
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: ZI/8052717; Labnumber: AGA-000858