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3-Chloro-4-fluoroaniline
SpectraBase Compound ID GyPXrTow2Nf
InChI InChI=1S/C6H5ClFN/c7-5-3-4(9)1-2-6(5)8/h1-3H,9H2
InChIKey YSEMCVGMNUUNRK-UHFFFAOYSA-N
Mol Weight 145.56 g/mol
Molecular Formula C6H5ClFN
Exact Mass 145.009455 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GrjQBopFrDo
Name 3-Chloro-4-fluoroaniline
Source of Sample Sigma-Aldrich Cat. #228583
CAS Registry Number 367-21-5
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 145.009455028 u
Formula C6H5ClFN
InChI InChI=1S/C6H5ClFN/c7-5-3-4(9)1-2-6(5)8/h1-3H,9H2
InChIKey YSEMCVGMNUUNRK-UHFFFAOYSA-N
Molecular Weight 145.564 g/mol
Number of Peaks 46
RI1 1224
SMILES Nc1ccc(F)c(Cl)c1
SPLASH splash10-0002-4900000000-89e3543c26113c381e2a
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, 3-chloro-4-fluoro-
Wiley ID LM_PEST_828