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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 CudNwc3cyzZ
Name 1H-pyrido[4,3-b]indolium, 2,3,4,4a,5,9b-hexahydro-2,8-dimethyl-5-(1-oxopropyl)-, chloride, (4aR,9bR)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.149891068 u
Formula C16H23ClN2O
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
Molecular Weight 294.826 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1327
Solvent DMSO-d6
Source Vendor ID: ZI/8052717; Lab Info: AGA; Lab Number: AGA-000858