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Trichlamide, N-pentafluoropropionyl-

View entire compound with spectra: 1 NMR

Trichlamide, N-pentafluoropropionyl-
SpectraBase Compound ID 5ofrWQSSBJt
InChI InChI=1S/C16H15Cl3F5NO4/c1-2-3-8-28-12(15(17,18)19)25-11(26)9-6-4-5-7-10(9)29-13(27)14(20,21)16(22,23)24/h4-7,12H,2-3,8H2,1H3,(H,25,26)
InChIKey GHRNNYVDPNBINL-UHFFFAOYSA-N
Mol Weight 486.65 g/mol
Molecular Formula C16H15Cl3F5NO4
Exact Mass 484.998682 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 923xKpSkRQf
Name Trichlamide, N-pentafluoropropionyl-
Comments Computed using HOSE algorithm
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Exact Mass 484.998681878 u
Formula C16H15Cl3F5NO4
InChI InChI=1S/C16H15Cl3F5NO4/c1-2-3-8-28-12(15(17,18)19)25-11(26)9-6-4-5-7-10(9)29-13(27)14(20,21)16(22,23)24/h4-7,12H,2-3,8H2,1H3,(H,25,26)
InChIKey GHRNNYVDPNBINL-UHFFFAOYSA-N
Molecular Weight 486.650 g/mol
SMILES C1(=CC=CC=C1OC(=O)C(C(F)(F)F)(F)F)C(NC(OCCCC)C(Cl)(Cl)Cl)=O