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1H-Indole-3-methanol, 1-benzoyl-4,5,6,7-tetrafluoro-, acetate(ester)
SpectraBase Compound ID ILL2J1cYHMS
InChI InChI=1S/C18H11F4NO3/c1-9(24)26-8-11-7-23(18(25)10-5-3-2-4-6-10)17-12(11)13(19)14(20)15(21)16(17)22/h2-7H,8H2,1H3
InChIKey DPTAXEZGJOFIKG-UHFFFAOYSA-N
Mol Weight 365.28 g/mol
Molecular Formula C18H11F4NO3
Exact Mass 365.067506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AwQckcUqj5h
Name 1H-Indole-3-methanol, 1-benzoyl-4,5,6,7-tetrafluoro-, acetate(ester)
CAS Registry Number 96491-07-5
Comments Less than 3 mono-isotopic peaks
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Formula C18H11F4NO3
InChI InChI=1S/C18H11F4NO3/c1-9(24)26-8-11-7-23(18(25)10-5-3-2-4-6-10)17-12(11)13(19)14(20)15(21)16(17)22/h2-7H,8H2,1H3
InChIKey DPTAXEZGJOFIKG-UHFFFAOYSA-N
Molecular Weight 365.284 g/mol
SMILES c12[n](cc(c2c(F)c(c(c1F)F)F)COC(=O)C)C(=O)c1ccccc1
SPLASH splash10-0a4i-0900000000-7971820829d3fa0e6433
Source of Spectrum J-54-4520-23
Synonyms (1-benzoyl-4,5,6,7-tetrafluoro-1H-indol-3-yl)methyl acetate 1-Benzoyl-3-(acetoxymethyl)-4,5,6,7-tetrafluoroindole
Wiley ID 1351322