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2-[(3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-2-quinolinyl)sulfanyl]-N-(3-methoxyphenyl)acetamide
SpectraBase Compound ID CcvMhmrLcBY
InChI InChI=1S/C21H21N3O3S/c1-21(2)9-17-16(18(25)10-21)7-13(11-22)20(24-17)28-12-19(26)23-14-5-4-6-15(8-14)27-3/h4-8H,9-10,12H2,1-3H3,(H,23,26)
InChIKey ARBSZMHHOXMXRK-UHFFFAOYSA-N
Mol Weight 395.48 g/mol
Molecular Formula C21H21N3O3S
Exact Mass 395.130363 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2N5YZ5vCtSk
Name 2-[(3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-2-quinolinyl)sulfanyl]-N-(3-methoxyphenyl)acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.130362719 u
Formula C21H21N3O3S
InChI InChI=1S/C21H21N3O3S/c1-21(2)9-17-16(18(25)10-21)7-13(11-22)20(24-17)28-12-19(26)23-14-5-4-6-15(8-14)27-3/h4-8H,9-10,12H2,1-3H3,(H,23,26)
InChIKey ARBSZMHHOXMXRK-UHFFFAOYSA-N
Molecular Weight 395.477 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1726
Solvent DMSO-d6
Source Vendor ID: NMR/12278312