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Dimethyl 2-(2-methyl-1-(2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl)propan-2-yl)succinate
SpectraBase Compound ID IZLQtGOTfCS
InChI InChI=1S/C17H17F7O4/c1-16(2,8(15(26)28-4)5-9(25)27-3)6-7-11(18)13(20)10(17(22,23)24)14(21)12(7)19/h8H,5-6H2,1-4H3
InChIKey WNFIKQOZPUKYKM-UHFFFAOYSA-N
Mol Weight 418.31 g/mol
Molecular Formula C17H17F7O4
Exact Mass 418.101506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KURNlsdkfjc
Name Dimethyl 2-(2-methyl-1-(2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl)propan-2-yl)succinate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17F7O4
InChI InChI=1S/C17H17F7O4/c1-16(2,8(15(26)28-4)5-9(25)27-3)6-7-11(18)13(20)10(17(22,23)24)14(21)12(7)19/h8H,5-6H2,1-4H3
InChIKey WNFIKQOZPUKYKM-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901135
Molecular Weight 418.308 g/mol
Reported Formula C17H17F7O4
SMILES C(OC)(C(C(Cc1c(c(c(c(c1F)F)C(F)(F)F)F)F)(C)C)CC(OC)=O)=O
SPLASH splash10-052s-5900000000-d17bebba9c6a33fbb0b7
Source of Spectrum U1-2020-SM13-3j-.beta.
Wiley ID 1858828