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7,7-Dimethyl-1-phenyl-4-(3-thienyl)-3,4,6,8-tetrahydroquinoline-2,5-dione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

7,7-Dimethyl-1-phenyl-4-(3-thienyl)-3,4,6,8-tetrahydroquinoline-2,5-dione
SpectraBase Compound ID 3UfdIHzWhpS
InChI InChI=1S/C21H21NO2S/c1-21(2)11-17-20(18(23)12-21)16(14-8-9-25-13-14)10-19(24)22(17)15-6-4-3-5-7-15/h3-9,13,16H,10-12H2,1-2H3
InChIKey RBZUYPGOVLZESC-UHFFFAOYSA-N
Mol Weight 351.46 g/mol
Molecular Formula C21H21NO2S
Exact Mass 351.1293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JRa0vF2HAHo
Name 7,7-Dimethyl-1-phenyl-4-(3-thienyl)-3,4,6,8-tetrahydroquinoline-2,5-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 351.129300092 u
Formula C21H21NO2S
InChI InChI=1S/C21H21NO2S/c1-21(2)11-17-20(18(23)12-21)16(14-8-9-25-13-14)10-19(24)22(17)15-6-4-3-5-7-15/h3-9,13,16H,10-12H2,1-2H3
InChIKey RBZUYPGOVLZESC-UHFFFAOYSA-N
Molecular Weight 351.464 g/mol
SMILES C1C(CC=2N(C3=CC=CC=C3)C(=O)CC(C3=CSC=C3)C2C1=O)(C)C