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Succinic acid, cyclohexylmethyl pentafluorophenyl ester
SpectraBase Compound ID Iiv23WCVoxc
InChI InChI=1S/C17H17F5O4/c18-12-13(19)15(21)17(16(22)14(12)20)26-11(24)7-6-10(23)25-8-9-4-2-1-3-5-9/h9H,1-8H2
InChIKey QXDJOKYPWIJHQS-UHFFFAOYSA-N
Mol Weight 380.31 g/mol
Molecular Formula C17H17F5O4
Exact Mass 380.1047 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3QSVZscgcdp
Name Succinic acid, cyclohexylmethyl pentafluorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 380.104699838 u
Formula C17H17F5O4
InChI InChI=1S/C17H17F5O4/c18-12-13(19)15(21)17(16(22)14(12)20)26-11(24)7-6-10(23)25-8-9-4-2-1-3-5-9/h9H,1-8H2
InChIKey QXDJOKYPWIJHQS-UHFFFAOYSA-N
Molecular Weight 380.311 g/mol
SMILES C(CC(OCC1CCCCC1)=O)C(OC1=C(C(=C(C(=C1F)F)F)F)F)=O