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2,2,3,3,4,4,4-heptafluorobutyl 5-(dithiolan-3-yl)pentanoate
SpectraBase Compound ID F6zFpZZaCQj
InChI InChI=1S/C12H15F7O2S2/c13-10(14,11(15,16)12(17,18)19)7-21-9(20)4-2-1-3-8-5-6-22-23-8/h8H,1-7H2
InChIKey ZSZWIKFNJWTNOE-UHFFFAOYSA-N
Mol Weight 388.36 g/mol
Molecular Formula C12H15F7O2S2
Exact Mass 388.040169 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EVmC89tRfOw
Name 2,2,3,3,4,4,4-heptafluorobutyl 5-(dithiolan-3-yl)pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.040169210 u
Formula C12H15F7O2S2
InChI InChI=1S/C12H15F7O2S2/c13-10(14,11(15,16)12(17,18)19)7-21-9(20)4-2-1-3-8-5-6-22-23-8/h8H,1-7H2
InChIKey ZSZWIKFNJWTNOE-UHFFFAOYSA-N
Instrument Name Waters
Ionization Type EI
Literature Reference DOI 10.1002/anie.202215329
Molecular Weight 388.359 g/mol
Quality 999
SMILES C1SSC(C1)CCCCC(OCC(C(C(F)(F)F)(F)F)(F)F)=O
SPLASH splash10-000i-9828000000-bd9be816aba0c9c26f01
Source of Spectrum ACI-62-SM83-Figure S71 (DOI: 10.1002/anie.202215329)
Wiley ID 1908267