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Glutaric acid, 2-ethylhexyl 4-fluoro-2-methoxyphenyl ester

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Glutaric acid, 2-ethylhexyl 4-fluoro-2-methoxyphenyl ester
SpectraBase Compound ID 6axj6WnxmkB
InChI InChI=1S/C20H29FO5/c1-4-6-8-15(5-2)14-25-19(22)9-7-10-20(23)26-17-12-11-16(21)13-18(17)24-3/h11-13,15H,4-10,14H2,1-3H3
InChIKey XRTIBUNULDAMRM-UHFFFAOYSA-N
Mol Weight 368.45 g/mol
Molecular Formula C20H29FO5
Exact Mass 368.199902 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KCLHmLrQZZG
Name Glutaric acid, 2-ethylhexyl 4-fluoro-2-methoxyphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 368.199902192 u
Formula C20H29FO5
InChI InChI=1S/C20H29FO5/c1-4-6-8-15(5-2)14-25-19(22)9-7-10-20(23)26-17-12-11-16(21)13-18(17)24-3/h11-13,15H,4-10,14H2,1-3H3
InChIKey XRTIBUNULDAMRM-UHFFFAOYSA-N
Molecular Weight 368.445 g/mol
SMILES C(CCC(OCC(CC)CCCC)=O)C(OC1=C(OC)C=C(C=C1)F)=O