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methanone, [4-(hexahydro-1H-azepin-1-yl)-6,7-dimethoxy-3-quinolinyl](4-methylphenyl)-

View entire compound with spectra: 1 NMR

methanone, [4-(hexahydro-1H-azepin-1-yl)-6,7-dimethoxy-3-quinolinyl](4-methylphenyl)-
SpectraBase Compound ID 6J3AtxRna2F
InChI InChI=1S/C25H28N2O3/c1-17-8-10-18(11-9-17)25(28)20-16-26-21-15-23(30-3)22(29-2)14-19(21)24(20)27-12-6-4-5-7-13-27/h8-11,14-16H,4-7,12-13H2,1-3H3
InChIKey RZQSPPPSUWTWFY-UHFFFAOYSA-N
Mol Weight 404.51 g/mol
Molecular Formula C25H28N2O3
Exact Mass 404.209993 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4HcVzZsnoaf
Name methanone, [4-(hexahydro-1H-azepin-1-yl)-6,7-dimethoxy-3-quinolinyl](4-methylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.209992767 u
Formula C25H28N2O3
InChI InChI=1S/C25H28N2O3/c1-17-8-10-18(11-9-17)25(28)20-16-26-21-15-23(30-3)22(29-2)14-19(21)24(20)27-12-6-4-5-7-13-27/h8-11,14-16H,4-7,12-13H2,1-3H3
InChIKey RZQSPPPSUWTWFY-UHFFFAOYSA-N
Molecular Weight 404.510 g/mol
NMR Offset 17.9973
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_8081
Solvent DMSO-d6
Source Vendor ID: NMR/13309069