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1-allyl-4,5,6,7-tetrafluoro-3-methyl-1H-indole
SpectraBase Compound ID AIHFEHFdER2
InChI InChI=1S/C12H9F4N/c1-3-4-17-5-6(2)7-8(13)9(14)10(15)11(16)12(7)17/h3,5H,1,4H2,2H3
InChIKey DCLGVXQEFMQNOS-UHFFFAOYSA-N
Mol Weight 243.2 g/mol
Molecular Formula C12H9F4N
Exact Mass 243.067112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ei6jJQKoH5H
Name 1-allyl-4,5,6,7-tetrafluoro-3-methyl-1H-indole
Alternate Name(s) 1-allyl-4,5,6,7-tetrafluoro-3-methyl-indole 4,5,6,7-tetrafluoro-3-methyl-1-prop-2-enylindole 4,5,6,7-tetrakis(fluoranyl)-3-methyl-1-prop-2-enyl-indole
CAS Registry Number 95264-58-7
Comments Less than 3 mono-isotopic peaks
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Formula C12H9F4N
InChI InChI=1S/C12H9F4N/c1-3-4-17-5-6(2)7-8(13)9(14)10(15)11(16)12(7)17/h3,5H,1,4H2,2H3
InChIKey DCLGVXQEFMQNOS-UHFFFAOYSA-N
Molecular Weight 243.205 g/mol
SMILES c12c([n](CC=C)cc2C)c(F)c(c(c1F)F)F
SPLASH splash10-0006-9040000000-1edad7f0a351b31f201a
Source of Spectrum J-54-4519-19
Wiley ID 1245918