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Succinic acid, phenethyl 2,2,3,3,4,4,4-heptafluorobutyl ester

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Succinic acid, phenethyl 2,2,3,3,4,4,4-heptafluorobutyl ester
SpectraBase Compound ID D9BdTpgcXz
InChI InChI=1S/C16H15F7O4/c17-14(18,15(19,20)16(21,22)23)10-27-13(25)7-6-12(24)26-9-8-11-4-2-1-3-5-11/h1-5H,6-10H2
InChIKey SLNYNXNPQFBTJC-UHFFFAOYSA-N
Mol Weight 404.28 g/mol
Molecular Formula C16H15F7O4
Exact Mass 404.085856 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6SEmXCvhhhQ
Name Succinic acid, phenethyl 2,2,3,3,4,4,4-heptafluorobutyl ester
Comments Computed using HOSE algorithm
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Exact Mass 404.085856100 u
Formula C16H15F7O4
InChI InChI=1S/C16H15F7O4/c17-14(18,15(19,20)16(21,22)23)10-27-13(25)7-6-12(24)26-9-8-11-4-2-1-3-5-11/h1-5H,6-10H2
InChIKey SLNYNXNPQFBTJC-UHFFFAOYSA-N
Molecular Weight 404.281 g/mol
SMILES C1=C(C=CC=C1)CCOC(=O)CCC(=O)OCC(C(C(F)(F)F)(F)F)(F)F