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Glutaric acid, oct-1-en-3-yl 2-fluorophenyl ester
SpectraBase Compound ID KYUfVkNdKvh
InChI InChI=1S/C19H25FO4/c1-3-5-6-10-15(4-2)23-18(21)13-9-14-19(22)24-17-12-8-7-11-16(17)20/h4,7-8,11-12,15H,2-3,5-6,9-10,13-14H2,1H3
InChIKey VYFZMZFEQCGVTC-UHFFFAOYSA-N
Mol Weight 336.4 g/mol
Molecular Formula C19H25FO4
Exact Mass 336.173687 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DLYQCwyExeP
Name Glutaric acid, oct-1-en-3-yl 2-fluorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 336.173687444 u
Formula C19H25FO4
InChI InChI=1S/C19H25FO4/c1-3-5-6-10-15(4-2)23-18(21)13-9-14-19(22)24-17-12-8-7-11-16(17)20/h4,7-8,11-12,15H,2-3,5-6,9-10,13-14H2,1H3
InChIKey VYFZMZFEQCGVTC-UHFFFAOYSA-N
Molecular Weight 336.403 g/mol
SMILES C(CCC(OC1=CC=CC=C1F)=O)C(OC(C=C)CCCCC)=O