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6-Methyl-1-fluoro-3-[(4'-methylphenyl)sulfenyl]hept-5-en-2-yl benzoate
SpectraBase Compound ID CGbUUo6Ww9o
InChI InChI=1S/C22H25FO2S/c1-16(2)9-14-21(26-19-12-10-17(3)11-13-19)20(15-23)25-22(24)18-7-5-4-6-8-18/h4-13,20-21H,14-15H2,1-3H3
InChIKey LOFGTYLUSMKEBV-UHFFFAOYSA-N
Mol Weight 372.5 g/mol
Molecular Formula C22H25FO2S
Exact Mass 372.155929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8sttLIz2AWE
Name 6-Methyl-1-fluoro-3-[(4'-methylphenyl)sulfenyl]hept-5-en-2-yl benzoate
Alternate Name(s) 1-(fluoromethyl)-5-methyl-2-[(4-methylphenyl)sulfanyl]-4-hexenyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25FO2S
InChI InChI=1S/C22H25FO2S/c1-16(2)9-14-21(26-19-12-10-17(3)11-13-19)20(15-23)25-22(24)18-7-5-4-6-8-18/h4-13,20-21H,14-15H2,1-3H3
InChIKey LOFGTYLUSMKEBV-UHFFFAOYSA-N
Molecular Weight 372.498 g/mol
SMILES C(OC(C(Sc1ccc(cc1)C)CC=C(C)C)CF)(=O)c1ccccc1
SPLASH splash10-0a6r-1931000000-347b101698772d533f2c
Source of Spectrum U1-1999-122-8
Wiley ID 752257