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3-(3-Methoxyphenyl)-N-[methyl(oxo)(phenyl)-lamda6-sulfaneylidene]propiolamide
SpectraBase Compound ID D9mYUOPZDpn
InChI InChI=1S/C17H15NO3S/c1-21-15-8-6-7-14(13-15)11-12-17(19)18-22(2,20)16-9-4-3-5-10-16/h3-10,13H,1-2H3
InChIKey AGGCKZZDQUZQGX-UHFFFAOYSA-N
Mol Weight 313.37 g/mol
Molecular Formula C17H15NO3S
Exact Mass 313.077265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 90tAsftzhFR
Name 3-(3-Methoxyphenyl)-N-[methyl(oxo)(phenyl)-lamda6-sulfaneylidene]propiolamide
Appearance Orange oil
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Formula C17H15NO3S
InChI InChI=1S/C17H15NO3S/c1-21-15-8-6-7-14(13-15)11-12-17(19)18-22(2,20)16-9-4-3-5-10-16/h3-10,13H,1-2H3
InChIKey AGGCKZZDQUZQGX-UHFFFAOYSA-N
Instrument Name Finnigan SSQ-7000
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202001440
Molecular Weight 313.371 g/mol
Reported Formula C17H15NO3S
SMILES c1cc(ccc1)S(=NC(C#Cc1cc(ccc1)OC)=O)(C)=O
SPLASH splash10-0a4i-0691000000-e79981b03c0503cff35b
Source of Spectrum ASC-363-SM16-2la
Wiley ID 1856414