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1,3,5-Tris(trifluoromethyl)benzene

View entire compound with spectra: 6 NMR, 1 FTIR, and 2 MS (GC)

1,3,5-Tris(trifluoromethyl)benzene
SpectraBase Compound ID 8x4jmMcmedt
InChI InChI=1S/C9H3F9/c10-7(11,12)4-1-5(8(13,14)15)3-6(2-4)9(16,17)18/h1-3H
InChIKey ZMAUHKSOLPYPDB-UHFFFAOYSA-N
Mol Weight 282.11 g/mol
Molecular Formula C9H3F9
Exact Mass 282.009104 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jX1VUI8tTp
Name 1,3,5-Tris(trifluoromethyl)benzene
CAS Registry Number 729-81-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H3F9
InChI InChI=1S/C9H3F9/c10-7(11,12)4-1-5(8(13,14)15)3-6(2-4)9(16,17)18/h1-3H
InChIKey ZMAUHKSOLPYPDB-UHFFFAOYSA-N
Molecular Weight 282.109 g/mol
SMILES C(F)(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(F)F
SPLASH splash10-03e9-1290000000-998ef13415b06532ebc2
Synonyms Benzene, 1,3,5-tris(trifluoromethyl)-
Wiley ID 1492914