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7-Chloro-4-iodo-6,6,7,7-tetrafluoroheptyl 2-hexynoate
SpectraBase Compound ID GrJSnV7qJTS
InChI InChI=1S/C13H16ClF4IO2/c1-2-3-4-7-11(20)21-8-5-6-10(19)9-12(15,16)13(14,17)18/h10H,2-3,5-6,8-9H2,1H3
InChIKey PANQJHAAZSXHTD-UHFFFAOYSA-N
Mol Weight 442.62 g/mol
Molecular Formula C13H16ClF4IO2
Exact Mass 441.981965 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Kjwapz3Cn3
Name 7-Chloro-4-iodo-6,6,7,7-tetrafluoroheptyl 2-hexynoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16ClF4IO2
InChI InChI=1S/C13H16ClF4IO2/c1-2-3-4-7-11(20)21-8-5-6-10(19)9-12(15,16)13(14,17)18/h10H,2-3,5-6,8-9H2,1H3
InChIKey PANQJHAAZSXHTD-UHFFFAOYSA-N
Molecular Weight 442.620 g/mol
SMILES C(C(F)(F)Cl)(CC(I)CCCOC(C#CCCC)=O)(F)F
SPLASH splash10-014r-5309100000-475d4e5e50ad4fadf6b9
Source of Spectrum F-51-2651-11
Synonyms 7-Chloro-6,6,7,7-tetrafluoro-4-iodoheptyl 2-hexynoate
Wiley ID 791190