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1,1,1,3,3,3-Hexafluoropropan-2-yl 2-methyl-3-phenylpropanoate
SpectraBase Compound ID A6EwTCcW7Oy
InChI InChI=1S/C13H12F6O2/c1-8(7-9-5-3-2-4-6-9)10(20)21-11(12(14,15)16)13(17,18)19/h2-6,8,11H,7H2,1H3
InChIKey XDLKPHQNBNXMDW-UHFFFAOYSA-N
Mol Weight 314.23 g/mol
Molecular Formula C13H12F6O2
Exact Mass 314.074149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ZbqBX8kbuh
Name 1,1,1,3,3,3-Hexafluoropropan-2-yl 2-methyl-3-phenylpropanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12F6O2
InChI InChI=1S/C13H12F6O2/c1-8(7-9-5-3-2-4-6-9)10(20)21-11(12(14,15)16)13(17,18)19/h2-6,8,11H,7H2,1H3
InChIKey XDLKPHQNBNXMDW-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol400785d
Molecular Weight 314.227 g/mol
SMILES c1cc(CC(C(=O)OC(C(F)(F)F)C(F)(F)F)C)ccc1
SPLASH splash10-0006-9101000000-334f5cc466636e93f903
Source of Spectrum A1-15-2222/SMS19-3w
Wiley ID 1748572