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2C-D HFB
SpectraBase Compound ID 5X3sNKqDQSY
InChI InChI=1S/C15H16F7NO3/c1-8-6-11(26-3)9(7-10(8)25-2)4-5-23-12(24)13(16,17)14(18,19)15(20,21)22/h6-7H,4-5H2,1-3H3,(H,23,24)
InChIKey XJLYWIOIPIVYIO-UHFFFAOYSA-N
Mol Weight 391.29 g/mol
Molecular Formula C15H16F7NO3
Exact Mass 391.101841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yTet8FvpVP
Name 2C-D HFBA Derivative
Alternate Name(s) N-(2,5-dimethoxy-4-methylphenethyl)-2,2,3,3,4,4,4-heptafluorobutanamide
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Formula C15H16F7NO3
InChI InChI=1S/C15H16F7NO3/c1-8-6-11(26-3)9(7-10(8)25-2)4-5-23-12(24)13(16,17)14(18,19)15(20,21)22/h6-7H,4-5H2,1-3H3,(H,23,24)
InChIKey XJLYWIOIPIVYIO-UHFFFAOYSA-N
Molecular Weight 391.286 g/mol
SMILES N(CCc1c(cc(c(c1)OC)C)OC)C(C(C(C(F)(F)F)(F)F)(F)F)=O
SPLASH splash10-00ou-2901000000-bc2d992b0e57f221e6d9
Source of Spectrum SWG-33-3427-0
Wiley ID 1810246