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(4-Hydroxyphenyl)pentylamine, di-pfp

View entire compound with spectra: 1 NMR

(4-Hydroxyphenyl)pentylamine, di-pfp
SpectraBase Compound ID 9nSF2MdblNr
InChI InChI=1S/C17H15F10NO3/c18-14(19,16(22,23)24)12(29)28-9-3-1-2-4-10-5-7-11(8-6-10)31-13(30)15(20,21)17(25,26)27/h5-8H,1-4,9H2,(H,28,29)
InChIKey PPECQTIFBGXUPC-UHFFFAOYSA-N
Mol Weight 471.3 g/mol
Molecular Formula C17H15F10NO3
Exact Mass 471.089225 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EvZJSbcmGZx
Name (4-Hydroxyphenyl)pentylamine, di-pfp
Comments Computed using HOSE algorithm
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Exact Mass 471.089224974 u
Formula C17H15F10NO3
InChI InChI=1S/C17H15F10NO3/c18-14(19,16(22,23)24)12(29)28-9-3-1-2-4-10-5-7-11(8-6-10)31-13(30)15(20,21)17(25,26)27/h5-8H,1-4,9H2,(H,28,29)
InChIKey PPECQTIFBGXUPC-UHFFFAOYSA-N
Molecular Weight 471.295 g/mol
SMILES C1=CC(=CC=C1OC(=O)C(F)(C(F)(F)F)F)CCCCCNC(=O)C(F)(C(F)(F)F)F