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N-(3-pyridyl)-S-methyl-S-phenylsulfoximine
SpectraBase Compound ID Db1p6iunEJ0
InChI InChI=1S/C12H12N2OS/c1-16(15,12-7-3-2-4-8-12)14-11-6-5-9-13-10-11/h2-10H,1H3
InChIKey VDHWEJTWTKVGRC-UHFFFAOYSA-N
Mol Weight 232.3 g/mol
Molecular Formula C12H12N2OS
Exact Mass 232.067034 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AUULkB8HBQN
Name N-(3-Pyridyl)-S-methyl-S-phenylsulfoximine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.067034187 u
Formula C12H12N2OS
InChI InChI=1S/C12H12N2OS/c1-16(15,12-7-3-2-4-8-12)14-11-6-5-9-13-10-11/h2-10H,1H3
InChIKey VDHWEJTWTKVGRC-UHFFFAOYSA-N
Molecular Weight 232.301 g/mol
SMILES C1(N=S(C=2C=CC=CC2)(C)=O)=CC=CN=C1