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Diethyl 4-(2,2,3,3,4,4,5,5,5-Nonafluoropentyl)-3,4-dihydronaphthalene-1,1(2H)-dicarboxylate
SpectraBase Compound ID KcXqcsMhwpf
InChI InChI=1S/C21H21F9O4/c1-3-33-15(31)17(16(32)34-4-2)10-9-12(13-7-5-6-8-14(13)17)11-18(22,23)19(24,25)20(26,27)21(28,29)30/h5-8,12H,3-4,9-11H2,1-2H3
InChIKey YXPXUPFYEMAZMQ-UHFFFAOYSA-N
Mol Weight 508.38 g/mol
Molecular Formula C21H21F9O4
Exact Mass 508.129613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5FdWycmqzFr
Name Diethyl 4-(2,2,3,3,4,4,5,5,5-Nonafluoropentyl)-3,4-dihydronaphthalene-1,1(2H)-dicarboxylate
Appearance Colorless yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21F9O4
InChI InChI=1S/C21H21F9O4/c1-3-33-15(31)17(16(32)34-4-2)10-9-12(13-7-5-6-8-14(13)17)11-18(22,23)19(24,25)20(26,27)21(28,29)30/h5-8,12H,3-4,9-11H2,1-2H3
InChIKey YXPXUPFYEMAZMQ-UHFFFAOYSA-N
Instrument Name Agilent Technologies 5973N
Ionization Type EI
Literature Reference DOI 10.1002/anie.202010839
Molecular Weight 508.381 g/mol
Reported Formula C21H21F9O4
SMILES C1(CC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)c2c(cccc2)C(CC1)(C(=O)OCC)C(=O)OCC
SPLASH splash10-03gi-0719610000-fdbd38221c4304aede15
Source of Spectrum ACI-60-SM37-15
Wiley ID 1880185