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methanone, [4-(3,4-dihydro-2(1H)-isoquinolinyl)-3-nitrophenyl](4-nitrophenyl)-

View entire compound with spectra: 1 NMR

methanone, [4-(3,4-dihydro-2(1H)-isoquinolinyl)-3-nitrophenyl](4-nitrophenyl)-
SpectraBase Compound ID 57S20zpGP5n
InChI InChI=1S/C22H17N3O5/c26-22(16-5-8-19(9-6-16)24(27)28)17-7-10-20(21(13-17)25(29)30)23-12-11-15-3-1-2-4-18(15)14-23/h1-10,13H,11-12,14H2
InChIKey BEENUDKRPYAKMY-UHFFFAOYSA-N
Mol Weight 403.39 g/mol
Molecular Formula C22H17N3O5
Exact Mass 403.116821 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ExvTdLRrSiA
Name methanone, [4-(3,4-dihydro-2(1H)-isoquinolinyl)-3-nitrophenyl](4-nitrophenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.116820654 u
Formula C22H17N3O5
InChI InChI=1S/C22H17N3O5/c26-22(16-5-8-19(9-6-16)24(27)28)17-7-10-20(21(13-17)25(29)30)23-12-11-15-3-1-2-4-18(15)14-23/h1-10,13H,11-12,14H2
InChIKey BEENUDKRPYAKMY-UHFFFAOYSA-N
Molecular Weight 403.394 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8111
Solvent DMSO-d6
Source Vendor ID: NMR/9301620; Lab Info: AI; Lab Number: AI-S000996
Temperature 29.85 °C