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N-[(4-Fluorophenyl)(methyl)(oxo)-lamda6-sulfaneylidene]-3-phenylpropiolamide
SpectraBase Compound ID LNMgv0lY1lA
InChI InChI=1S/C16H12FNO2S/c1-21(20,15-10-8-14(17)9-11-15)18-16(19)12-7-13-5-3-2-4-6-13/h2-6,8-11H,1H3
InChIKey TVQLUQFEHBFAMY-UHFFFAOYSA-N
Mol Weight 301.34 g/mol
Molecular Formula C16H12FNO2S
Exact Mass 301.057278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BXykgqqlVI5
Name N-[(4-Fluorophenyl)(methyl)(oxo)-lamda6-sulfaneylidene]-3-phenylpropiolamide
Appearance Orange oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12FNO2S
InChI InChI=1S/C16H12FNO2S/c1-21(20,15-10-8-14(17)9-11-15)18-16(19)12-7-13-5-3-2-4-6-13/h2-6,8-11H,1H3
InChIKey TVQLUQFEHBFAMY-UHFFFAOYSA-N
Instrument Name Finnigan SSQ-7000
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202001440
Molecular Weight 301.335 g/mol
Reported Formula C16H12FNO2S
SMILES c1cc(ccc1F)S(=NC(C#Cc1ccccc1)=O)(C)=O
SPLASH splash10-0096-0910000000-fae4a4c102f8f82e0379
Source of Spectrum ASC-363-SM5-2ad
Wiley ID 1856389