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S-4-(2,2,3,3,4,4,4-heptafluorobutanamido)phenyl 2,2,3,3,4,4,4-heptafluorobutanethioate

View entire compound with spectra: 1 MS (GC)

S-4-(2,2,3,3,4,4,4-heptafluorobutanamido)phenyl 2,2,3,3,4,4,4-heptafluorobutanethioate
SpectraBase Compound ID JJsZFHXVveI
InChI InChI=1S/C14H5F14NO2S/c15-9(16,11(19,20)13(23,24)25)7(30)29-5-1-3-6(4-2-5)32-8(31)10(17,18)12(21,22)14(26,27)28/h1-4H,(H,29,30)
InChIKey AHATVAQWEHBVBS-UHFFFAOYSA-N
Mol Weight 517.24 g/mol
Molecular Formula C14H5F14NO2S
Exact Mass 516.981744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ctmet3OaVF
Name S-4-(2,2,3,3,4,4,4-heptafluorobutanamido)phenyl 2,2,3,3,4,4,4-heptafluorobutanethioate
Alternate Name(s) S-(4-(2,2,3,3,4,4,4-heptafluorobutanamido)phenyl) 2,2,3,3,4,4,4-heptafluorobutanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H5F14NO2S
InChI InChI=1S/C14H5F14NO2S/c15-9(16,11(19,20)13(23,24)25)7(30)29-5-1-3-6(4-2-5)32-8(31)10(17,18)12(21,22)14(26,27)28/h1-4H,(H,29,30)
InChIKey AHATVAQWEHBVBS-UHFFFAOYSA-N
Literature Reference DOI 10.1002/rcm.4661
Molecular Weight 517.237 g/mol
SMILES N(c1ccc(cc1)SC(=O)C(C(C(F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)=O
SPLASH splash10-00fr-0509030000-21409575b2b1e51bfa6d
Source of Spectrum RCM-24-2531-para_3c
Wiley ID 1814676