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2-(4-Methoxybenzylsulfinyl)-N-methylbenzamide
SpectraBase Compound ID D1wrjk0ZXms
InChI InChI=1S/C16H17NO3S/c1-17-16(18)14-5-3-4-6-15(14)21(19)11-12-7-9-13(20-2)10-8-12/h3-10H,11H2,1-2H3,(H,17,18)
InChIKey BVCIAZGXSRCXQY-UHFFFAOYSA-N
Mol Weight 303.38 g/mol
Molecular Formula C16H17NO3S
Exact Mass 303.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfVZhnuRnSe
Name 2-(4-Methoxybenzylsulfinyl)-N-methylbenzamide
Alternate Name(s) 2-[(4-methoxyphenyl)methylsulfinyl]-N-methylbenzamide 2-[(4-methoxyphenyl)methylsulfinyl]-N-methyl-benzamide
Comments Less than 3 mono-isotopic peaks
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Formula C16H17NO3S
InChI InChI=1S/C16H17NO3S/c1-17-16(18)14-5-3-4-6-15(14)21(19)11-12-7-9-13(20-2)10-8-12/h3-10H,11H2,1-2H3,(H,17,18)
InChIKey BVCIAZGXSRCXQY-UHFFFAOYSA-N
Molecular Weight 303.376 g/mol
SMILES N(C(c1c(S(Cc2ccc(cc2)OC)=O)cccc1)=O)C
SPLASH splash10-0udi-0009000000-dade378c2078da27ebc5
Source of Spectrum F-67-5277-1b
Wiley ID 1686922