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4-(Trifluoromethoxy)aniline
SpectraBase Compound ID 7nRouW2Qmca
InChI InChI=1S/C7H6F3NO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H,11H2
InChIKey XUJFOSLZQITUOI-UHFFFAOYSA-N
Mol Weight 177.13 g/mol
Molecular Formula C7H6F3NO
Exact Mass 177.040148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdW4ZxKVf5U
Name 4-(Trifluoromethoxy)aniline
Source of Sample LGC Cat. #DRE-C17844810; www.lgcstandards.com
CAS Registry Number 461-82-5
Classification Pesticides
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 177.040148305 u
Formula C7H6F3NO
InChI InChI=1S/C7H6F3NO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H,11H2
InChIKey XUJFOSLZQITUOI-UHFFFAOYSA-N
Molecular Weight 177.126 g/mol
Number of Peaks 94
RI1 1053
RI2 1034
SMILES Nc1ccc(cc1)OC(F)(F)F
SPLASH splash10-0a6r-6900000000-5cf9f10618399f8fae19
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Benzenamine, 4-(trifluoromethoxy)-
Wiley ID LM_PEST_975