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Acetamide, N-[4-methyl-2-[3-(methylsulfinyl)-2-oxopropyl]phenyl]-
SpectraBase Compound ID 7brDNQDeUEn
InChI InChI=1S/C13H17NO3S/c1-9-4-5-13(14-10(2)15)11(6-9)7-12(16)8-18(3)17/h4-6H,7-8H2,1-3H3,(H,14,15)
InChIKey IYUOTKBZUUWDHH-UHFFFAOYSA-N
Mol Weight 267.34 g/mol
Molecular Formula C13H17NO3S
Exact Mass 267.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IPw996CMWC0
Name Acetamide, N-[4-methyl-2-[3-(methylsulfinyl)-2-oxopropyl]phenyl]-
Alternate Name(s) N-{4-methyl-2-[2-oxo-3-(methylsulfinyl)propyl]phenyl}acetamid N-{4-methyl-2-[3-(methylsulfinyl)-2-oxopropyl]phenyl}acetamide
CAS Registry Number 104737-14-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO3S
InChI InChI=1S/C13H17NO3S/c1-9-4-5-13(14-10(2)15)11(6-9)7-12(16)8-18(3)17/h4-6H,7-8H2,1-3H3,(H,14,15)
InChIKey IYUOTKBZUUWDHH-UHFFFAOYSA-N
Molecular Weight 267.343 g/mol
SMILES N(c1c(CC(CS(=O)C)=O)cc(cc1)C)C(=O)C
SPLASH splash10-0h90-0960000000-f0b4f24271fb5952200a
Source of Spectrum H-68-1839-5
Wiley ID 1271041