For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
isoquinolinium, 6,7-diethoxy-1,2,3,4-tetrahydro-1-[4-(trifluoromethyl)phenyl]-, chloride
SpectraBase Compound ID 1zGP5zvjuOH
InChI InChI=1S/C20H22F3NO2.ClH/c1-3-25-17-11-14-9-10-24-19(16(14)12-18(17)26-4-2)13-5-7-15(8-6-13)20(21,22)23;/h5-8,11-12,19,24H,3-4,9-10H2,1-2H3;1H
InChIKey RVBHQHPOBUYKSB-UHFFFAOYSA-N
Mol Weight 401.86 g/mol
Molecular Formula C20H23ClF3NO2
Exact Mass 401.136941 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BRCBl2Sl1Jo
Name isoquinolinium, 6,7-diethoxy-1,2,3,4-tetrahydro-1-[4-(trifluoromethyl)phenyl]-, chloride
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.136941172 u
Formula C20H23ClF3NO2
InChI InChI=1S/C20H22F3NO2.ClH/c1-3-25-17-11-14-9-10-24-19(16(14)12-18(17)26-4-2)13-5-7-15(8-6-13)20(21,22)23;/h5-8,11-12,19,24H,3-4,9-10H2,1-2H3;1H
InChIKey RVBHQHPOBUYKSB-UHFFFAOYSA-N
Molecular Weight 401.857 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15931
Solvent DMSO-d6
Source Vendor ID: NMR/10300780; Lab Info: GRI; Lab Number: GRI-0000034