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isoquinolinium, 6,7-diethoxy-1-(9H-fluoren-2-yl)-1,2,3,4-tetrahydro-,chloride
SpectraBase Compound ID IsTcpKOWpv6
InChI InChI=1S/C26H27NO2.ClH/c1-3-28-24-15-18-11-12-27-26(23(18)16-25(24)29-4-2)19-9-10-22-20(14-19)13-17-7-5-6-8-21(17)22;/h5-10,14-16,26-27H,3-4,11-13H2,1-2H3;1H
InChIKey COJBMPOQSWZTRV-UHFFFAOYSA-N
Mol Weight 421.97 g/mol
Molecular Formula C26H28ClNO2
Exact Mass 421.180857 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CILVudSlW4K
Name isoquinolinium, 6,7-diethoxy-1-(9H-fluoren-2-yl)-1,2,3,4-tetrahydro-,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 421.180856844 u
Formula C26H28ClNO2
InChI InChI=1S/C26H27NO2.ClH/c1-3-28-24-15-18-11-12-27-26(23(18)16-25(24)29-4-2)19-9-10-22-20(14-19)13-17-7-5-6-8-21(17)22;/h5-10,14-16,26-27H,3-4,11-13H2,1-2H3;1H
InChIKey COJBMPOQSWZTRV-UHFFFAOYSA-N
Molecular Weight 421.968 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15391
Solvent DMSO-d6
Source Vendor ID: NMR/11240456; Lab Info: GRIN; Lab Number: GRIN-0103122