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2,6-Octadien-4-one, 3-fluoro-2,7-dimethyl-5-[(4-methylphenyl)sulfonyl]-, (.+-.)-
SpectraBase Compound ID ApmaTTGrSY4
InChI InChI=1S/C17H21FO3S/c1-11(2)10-15(17(19)16(18)12(3)4)22(20,21)14-8-6-13(5)7-9-14/h6-10,15H,1-5H3
InChIKey LUVVMFJOQJRUCU-UHFFFAOYSA-N
Mol Weight 324.41 g/mol
Molecular Formula C17H21FO3S
Exact Mass 324.119544 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTtt4dDY4RR
Name 2,6-Octadien-4-one, 3-fluoro-2,7-dimethyl-5-[(4-methylphenyl)sulfonyl]-, (.+-.)-
Alternate Name(s) 3-Flioro-2,7-dimethyl-5-p-totylsulfonyl-2,6-octadien-4-one 3-Fluoro-2,7-dimethyl-5-[(4-methylphenyl)sulfonyl]-2,6-octadien-4-one
CAS Registry Number 123502-05-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21FO3S
InChI InChI=1S/C17H21FO3S/c1-11(2)10-15(17(19)16(18)12(3)4)22(20,21)14-8-6-13(5)7-9-14/h6-10,15H,1-5H3
InChIKey LUVVMFJOQJRUCU-UHFFFAOYSA-N
Molecular Weight 324.410 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)(C(C(=C(C)C)F)=O)C=C(C)C
SPLASH splash10-014l-3901000000-76d8f1bdea35420ac3de
Source of Spectrum F-44-7136-0
Wiley ID 1323087