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N-(3,3-diphenylpropyl)-2,2,3,3,4,4,4-heptafluorobutanamide
SpectraBase Compound ID 4vRKHeqfFlE
InChI InChI=1S/C19H16F7NO/c20-17(21,18(22,23)19(24,25)26)16(28)27-12-11-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15H,11-12H2,(H,27,28)
InChIKey CLTVQFHMUAFZOR-UHFFFAOYSA-N
Mol Weight 407.33 g/mol
Molecular Formula C19H16F7NO
Exact Mass 407.112011 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KpPiWhxCRym
Name N-(3,3-Diphenylpropyl)-2,2,3,3,4,4,4-heptafluorobutanamide
Comments Computed using HOSE algorithm
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Exact Mass 407.112011279 u
Formula C19H16F7NO
InChI InChI=1S/C19H16F7NO/c20-17(21,18(22,23)19(24,25)26)16(28)27-12-11-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15H,11-12H2,(H,27,28)
InChIKey CLTVQFHMUAFZOR-UHFFFAOYSA-N
Molecular Weight 407.332 g/mol
SMILES N(C(C(C(C(F)(F)F)(F)F)(F)F)=O)CCC(C1=CC=CC=C1)C=1C=CC=CC1