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1-([BROMO-(TRIFLUOROMETHYLSULFONYL)-OXY]-METHYLIDENE)-1,2,3,4,6,10B-HEXAHYDRO-PYRIDO-[2,1-A]-ISOINDOL-6-ONE
SpectraBase Compound ID 2mmPunfYnPM
InChI InChI=1S/C14H11BrF3NO4S/c15-12(23-24(21,22)14(16,17)18)10-6-3-7-19-11(10)8-4-1-2-5-9(8)13(19)20/h1-2,4-5,11H,3,6-7H2/b12-10+
InChIKey HOTFDZWKCLXCSF-ZRDIBKRKSA-N
Mol Weight 426.2 g/mol
Molecular Formula C14H11BrF3NO4S
Exact Mass 424.954426 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIuUZL43JSK
Name 9-{Bromo[(trifluoromethylsulfonyl)oxy]methylidene}-1,2,3,4,6,10b-hexahydropyrido[2,1-a]isoindol-6-one
Alternate Name(s) (Z)-bromo(6-oxo-3,4,6,10b-tetrahydropyrido[2,1-a]isoindol-1(2H)-ylidene)methyl trifluoromethanesulfonate
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Formula C14H11BrF3NO4S
InChI InChI=1S/C14H11BrF3NO4S/c15-12(23-24(21,22)14(16,17)18)10-6-3-7-19-11(10)8-4-1-2-5-9(8)13(19)20/h1-2,4-5,11H,3,6-7H2/b12-10+
InChIKey HOTFDZWKCLXCSF-ZRDIBKRKSA-N
Molecular Weight 426.204 g/mol
SMILES C12\C(=C\(OS(C(F)(F)F)(=O)=O)Br)CCCN2C(=O)c2c1cccc2
SPLASH splash10-000i-2930000000-5e2e388a2c9f5426ef0a
Source of Spectrum AC-1994-101-25
Wiley ID 811745