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[(E)-1-methyl-2-(trifluoromethyl)undec-1-en-3-ynyl]sulfonylbenzene
SpectraBase Compound ID AwDwJekHRDI
InChI InChI=1S/C19H23F3O2S/c1-3-4-5-6-7-8-12-15-18(19(20,21)22)16(2)25(23,24)17-13-10-9-11-14-17/h9-11,13-14H,3-8H2,1-2H3/b18-16+
InChIKey NMBWHWGCXKWXLA-FBMGVBCBSA-N
Mol Weight 372.45 g/mol
Molecular Formula C19H23F3O2S
Exact Mass 372.137086 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4RtboyvMNUQ
Name [(E)-1-methyl-2-(trifluoromethyl)undec-1-en-3-ynyl]sulfonylbenzene
Alternate Name(s) [(E)-3-(trifluoromethyl)dodec-2-en-4-yn-2-yl]sulfonylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23F3O2S
InChI InChI=1S/C19H23F3O2S/c1-3-4-5-6-7-8-12-15-18(19(20,21)22)16(2)25(23,24)17-13-10-9-11-14-17/h9-11,13-14H,3-8H2,1-2H3/b18-16+
InChIKey NMBWHWGCXKWXLA-FBMGVBCBSA-N
Molecular Weight 372.446 g/mol
SMILES c1(S(=O)(=O)\C(=C/(C#CCCCCCCC)C(F)(F)F)C)ccccc1
SPLASH splash10-0002-0910000000-70a43a99da6189f5b176
Source of Spectrum K-2001-522-4
Wiley ID 1578668