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3-[3,4-(Methylenedioxy)phenyl]-3-[(o-aminophenyl)thio]propiophenone

View entire compound with spectra: 1 NMR, and 2 UV-Vis

3-[3,4-(Methylenedioxy)phenyl]-3-[(o-aminophenyl)thio]propiophenone
SpectraBase Compound ID 24OK6P9jLCn
InChI InChI=1S/C22H19NO3S/c23-17-8-4-5-9-21(17)27-22(13-18(24)15-6-2-1-3-7-15)16-10-11-19-20(12-16)26-14-25-19/h1-12,22H,13-14,23H2
InChIKey GREKXRGVSVVDFY-UHFFFAOYSA-N
Mol Weight 377.46 g/mol
Molecular Formula C22H19NO3S
Exact Mass 377.108565 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4LkMKKbc5Kc
Name 3-[3,4-(Methylenedioxy)phenyl]-3-[(o-aminophenyl)thio]propiophenone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 377.108564647 u
Formula C22H19NO3S
InChI InChI=1S/C22H19NO3S/c23-17-8-4-5-9-21(17)27-22(13-18(24)15-6-2-1-3-7-15)16-10-11-19-20(12-16)26-14-25-19/h1-12,22H,13-14,23H2
InChIKey GREKXRGVSVVDFY-UHFFFAOYSA-N
Molecular Weight 377.458 g/mol
SMILES NC1=CC=CC=C1SC(CC(C1=CC=CC=C1)=O)C=1C=C2OCOC2=CC1