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Pentyl 2,6-difluorobenzoate

View entire compound with spectra: 1 MS (GC)

Pentyl 2,6-difluorobenzoate
SpectraBase Compound ID 78agnIajjyB
InChI InChI=1S/C12H14F2O2/c1-2-3-4-8-16-12(15)11-9(13)6-5-7-10(11)14/h5-7H,2-4,8H2,1H3
InChIKey HEEPDOQIZZNGNE-UHFFFAOYSA-N
Mol Weight 228.24 g/mol
Molecular Formula C12H14F2O2
Exact Mass 228.096186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Piz08G20Dm
Name Pentyl 2,6-difluorobenzoate
Alternate Name(s) 2,6-Difluorobenzoic acid, pentyl ester 2,6-Difluorobenzoic acid pentyl ester Pentyl 2,6-bis(fluoranyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14F2O2
InChI InChI=1S/C12H14F2O2/c1-2-3-4-8-16-12(15)11-9(13)6-5-7-10(11)14/h5-7H,2-4,8H2,1H3
InChIKey HEEPDOQIZZNGNE-UHFFFAOYSA-N
Molecular Weight 228.239 g/mol
SMILES C(=O)(OCCCCC)c1c(F)cccc1F
SPLASH splash10-052f-1900000000-1b694bea6c89282cde85
Source of Spectrum NP-5-7962-0
Wiley ID 1105144