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2-Bromo-3-oxocyclohex-1-enyl triflate
SpectraBase Compound ID 29Fs7mFGfdK
InChI InChI=1S/C7H6BrF3O4S/c8-6-4(12)2-1-3-5(6)15-16(13,14)7(9,10)11/h1-3H2
InChIKey ZCPDDXNMNWKFIT-UHFFFAOYSA-N
Mol Weight 323.08 g/mol
Molecular Formula C7H6BrF3O4S
Exact Mass 321.912227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8VC2NiZbi9
Name 2-Bromo-3-oxocyclohex-1-enyl triflate
Alternate Name(s) 2-Bromo-3-oxo-1-cyclohexen-1-yl trifluoromethanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6BrF3O4S
InChI InChI=1S/C7H6BrF3O4S/c8-6-4(12)2-1-3-5(6)15-16(13,14)7(9,10)11/h1-3H2
InChIKey ZCPDDXNMNWKFIT-UHFFFAOYSA-N
Molecular Weight 323.080 g/mol
SMILES C(S(OC1=C(C(=O)CCC1)Br)(=O)=O)(F)(F)F
SPLASH splash10-00xr-5109000000-7c8dc4f2fe4ae08bab3c
Source of Spectrum QE-7-4041-2
Wiley ID 845881