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4-(N,N-Dimethylamino)-4-[(p-tolylsulfinyl)methyl]-2,5-cyclohexadien-1-one
SpectraBase Compound ID 6baLDWNFzpt
InChI InChI=1S/C16H19NO2S/c1-13-4-6-15(7-5-13)20(19)12-16(17(2)3)10-8-14(18)9-11-16/h4-11H,12H2,1-3H3
InChIKey PBUIHMKYNWQTFZ-UHFFFAOYSA-N
Mol Weight 289.39 g/mol
Molecular Formula C16H19NO2S
Exact Mass 289.11365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6PgtpDO9ihN
Name 4-(N,N-Dimethylamino)-4-[(p-tolylsulfinyl)methyl]-2,5-cyclohexadien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO2S
InChI InChI=1S/C16H19NO2S/c1-13-4-6-15(7-5-13)20(19)12-16(17(2)3)10-8-14(18)9-11-16/h4-11H,12H2,1-3H3
InChIKey PBUIHMKYNWQTFZ-UHFFFAOYSA-N
Molecular Weight 289.393 g/mol
SMILES C1(CS(c2ccc(cc2)C)=O)(C=CC(C=C1)=O)N(C)C
SPLASH splash10-00kr-0590000000-e4dc2a7fb7565046f3d6
Source of Spectrum QE-14-631-22
Wiley ID 1691872