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3,4-Dichloroaniline
SpectraBase Compound ID FJ1uB5vn8BE
InChI InChI=1S/C6H5Cl2N/c7-5-2-1-4(9)3-6(5)8/h1-3H,9H2
InChIKey SDYWXFYBZPNOFX-UHFFFAOYSA-N
Mol Weight 162.02 g/mol
Molecular Formula C6H5Cl2N
Exact Mass 160.979905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ko78bWIo2Nb
Name 3,4-Dichloroaniline
Source of Sample Sigma-Aldrich Cat. #35827
CAS Registry Number 95-76-1
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 160.979904565 u
Formula C6H5Cl2N
InChI InChI=1S/C6H5Cl2N/c7-5-2-1-4(9)3-6(5)8/h1-3H,9H2
InChIKey SDYWXFYBZPNOFX-UHFFFAOYSA-N
Molecular Weight 162.019 g/mol
Number of Peaks 46
RI1 1427
SMILES Nc1ccc(c(c1)Cl)Cl
SPLASH splash10-03di-4900000000-ba4db51def8c8c8ff4a1
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, 3,4-dichloro-
Wiley ID LM_PEST_786