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Octadecyl 2,6-difluorobenzoate

View entire compound with spectra: 1 MS (GC)

Octadecyl 2,6-difluorobenzoate
SpectraBase Compound ID 96omWdMhNsC
InChI InChI=1S/C25H40F2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-29-25(28)24-22(26)19-18-20-23(24)27/h18-20H,2-17,21H2,1H3
InChIKey XOWVGUWZAIOVHI-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C25H40F2O2
Exact Mass 410.299637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ywInuOUmtd
Name Octadecyl 2,6-difluorobenzoate
Alternate Name(s) 2,6-Difluorobenzoic acid, octadecyl ester 2,6-Difluorobenzoic acid octadecyl ester Octadecyl 2,6-bis(fluoranyl)benzoate
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Formula C25H40F2O2
InChI InChI=1S/C25H40F2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-29-25(28)24-22(26)19-18-20-23(24)27/h18-20H,2-17,21H2,1H3
InChIKey XOWVGUWZAIOVHI-UHFFFAOYSA-N
Molecular Weight 410.590 g/mol
SMILES C(=O)(OCCCCCCCCCCCCCCCCCC)c1c(F)cccc1F
SPLASH splash10-0a4i-5900000000-1dab5e82bff2b010464a
Source of Spectrum NP-14-6811-0
Wiley ID 1111919