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(2-Benzylsulfanyl-phenyl)-(3,4-dihydro-2H-quinolin-1-yl)-methanone

View entire compound with spectra: 2 NMR, and 1 MS (GC)

(2-Benzylsulfanyl-phenyl)-(3,4-dihydro-2H-quinolin-1-yl)-methanone
SpectraBase Compound ID 4GLcDSrJgeF
InChI InChI=1S/C23H21NOS/c25-23(24-16-8-12-19-11-4-6-14-21(19)24)20-13-5-7-15-22(20)26-17-18-9-2-1-3-10-18/h1-7,9-11,13-15H,8,12,16-17H2
InChIKey GSRCZVCDOOFTKL-UHFFFAOYSA-N
Mol Weight 359.49 g/mol
Molecular Formula C23H21NOS
Exact Mass 359.134385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K5ZBQoOaKnj
Name (2-Benzylsulfanyl-phenyl)-(3,4-dihydro-2H-quinolin-1-yl)-methanone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.134385473 u
Formula C23H21NOS
InChI InChI=1S/C23H21NOS/c25-23(24-16-8-12-19-11-4-6-14-21(19)24)20-13-5-7-15-22(20)26-17-18-9-2-1-3-10-18/h1-7,9-11,13-15H,8,12,16-17H2
InChIKey GSRCZVCDOOFTKL-UHFFFAOYSA-N
Molecular Weight 359.487 g/mol
SMILES C(N1C2=C(C=CC=C2)CCC1)(C1=C(SCC2=CC=CC=C2)C=CC=C1)=O