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2,2,3,3,3-Pentafluoro-1-(4-hydroxy-2H-thiochromen-3-yl)-propan-1-one
SpectraBase Compound ID 66a4L5e6nan
InChI InChI=1S/C12H7F5O2S/c13-11(14,12(15,16)17)10(19)7-5-20-8-4-2-1-3-6(8)9(7)18/h1-4,18H,5H2
InChIKey ZYDFPBODNVDLAW-UHFFFAOYSA-N
Mol Weight 310.24 g/mol
Molecular Formula C12H7F5O2S
Exact Mass 310.008691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3kDHbKKOyyr
Name 2,2,3,3,3-Pentafluoro-1-(4-hydroxy-2H-thiochromen-3-yl)-propan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7F5O2S
InChI InChI=1S/C12H7F5O2S/c13-11(14,12(15,16)17)10(19)7-5-20-8-4-2-1-3-6(8)9(7)18/h1-4,18H,5H2
InChIKey ZYDFPBODNVDLAW-UHFFFAOYSA-N
Molecular Weight 310.238 g/mol
SMILES OC1=C(C(C(C(F)(F)F)(F)F)=O)CSc2c1cccc2
SPLASH splash10-03di-0917000000-f199fce6c4dd24e9d22b
Source of Spectrum F-65-7545-9c
Synonyms 3-(Pentafluoropropanoyl)thiochromanone
Wiley ID 1680357