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4-Fluoro-4-(phenylsulfinyl)-5-tetradecanone

View entire compound with spectra: 1 MS (GC)

4-Fluoro-4-(phenylsulfinyl)-5-tetradecanone
SpectraBase Compound ID 3RJoMrhX1P
InChI InChI=1S/C20H31FO2S/c1-3-5-6-7-8-9-13-16-19(22)20(21,17-4-2)24(23)18-14-11-10-12-15-18/h10-12,14-15H,3-9,13,16-17H2,1-2H3
InChIKey ZVCJMGOFLZTOCX-UHFFFAOYSA-N
Mol Weight 354.52 g/mol
Molecular Formula C20H31FO2S
Exact Mass 354.20288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KIQ7hem28Gz
Name 4-Fluoro-4-(phenylsulfinyl)-5-tetradecanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31FO2S
InChI InChI=1S/C20H31FO2S/c1-3-5-6-7-8-9-13-16-19(22)20(21,17-4-2)24(23)18-14-11-10-12-15-18/h10-12,14-15H,3-9,13,16-17H2,1-2H3
InChIKey ZVCJMGOFLZTOCX-UHFFFAOYSA-N
Molecular Weight 354.524 g/mol
SMILES CCCC(C(CCCCCCCCC)=O)(S(=O)c1ccccc1)F
SPLASH splash10-014j-0910000000-e11affa8eca3bc5f9fb9
Source of Spectrum AJ-65-2803-2
Wiley ID 771612