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(E)-3-(p-tolyl)allyl 2,3,6-trifluorobenzoate
SpectraBase Compound ID 5M7EJrOIcMJ
InChI InChI=1S/C17H13F3O2/c1-11-4-6-12(7-5-11)3-2-10-22-17(21)15-13(18)8-9-14(19)16(15)20/h2-9H,10H2,1H3/b3-2+
InChIKey KDVNYJMIJFYZAD-NSCUHMNNSA-N
Mol Weight 306.28 g/mol
Molecular Formula C17H13F3O2
Exact Mass 306.086764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JPrCuwNdjzR
Name (E)-3-(p-tolyl)allyl 2,3,6-trifluorobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13F3O2
InChI InChI=1S/C17H13F3O2/c1-11-4-6-12(7-5-11)3-2-10-22-17(21)15-13(18)8-9-14(19)16(15)20/h2-9H,10H2,1H3/b3-2+
InChIKey KDVNYJMIJFYZAD-NSCUHMNNSA-N
Literature Reference DOI 10.1002/adsc.201400624
Molecular Weight 306.284 g/mol
SMILES C(c1c(c(ccc1F)F)F)(=O)OC\C=C\c1ccc(cc1)C
SPLASH splash10-0apj-0900000000-924f6022c5cec8ba0ad4
Source of Spectrum ASC-356-3302/SM14-1t
Wiley ID 1769750