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4-(Trifluoromethoxy)toluene
SpectraBase Compound ID LlaRQGsV0ld
InChI InChI=1S/C8H7F3O/c1-6-2-4-7(5-3-6)12-8(9,10)11/h2-5H,1H3
InChIKey JUXFXYQUXNXVAA-UHFFFAOYSA-N
Mol Weight 176.14 g/mol
Molecular Formula C8H7F3O
Exact Mass 176.044899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BhnEv1xZlwc
Name 4-(trifluoromethoxy)toluene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 176.044899333 u
Formula C8H7F3O
GC Column DB-5 MS fused silica (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 220oC
InChI InChI=1S/C8H7F3O/c1-6-2-4-7(5-3-6)12-8(9,10)11/h2-5H,1H3
InChIKey JUXFXYQUXNXVAA-UHFFFAOYSA-N
Instrument Name Shimadzu GC-17A-QP5050A or Shimadzu GC-2010-QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/chem.202102757
Molecular Weight 176.138 g/mol
Quality 985
SMILES C1(OC(F)(F)F)=CC=C(C=C1)C
SPLASH splash10-004l-9400000000-4e801dd5419960e4bad1
Source of Spectrum QE-27-SM28-28-1 (DOI: 10.1002/chem.202102757)
Wiley ID 1904145