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4-Bromoaniline
SpectraBase Compound ID COoGMt2qNvX
InChI InChI=1S/C6H6BrN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2
InChIKey WDFQBORIUYODSI-UHFFFAOYSA-N
Mol Weight 172.03 g/mol
Molecular Formula C6H6BrN
Exact Mass 170.968362 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KyXITBNrz5V
Name 4-Bromoaniline
Source of Sample Sigma-Aldrich Cat. #16230
CAS Registry Number 106-40-1
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 170.968362197 u
Formula C6H6BrN
InChI InChI=1S/C6H6BrN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2
InChIKey WDFQBORIUYODSI-UHFFFAOYSA-N
Molecular Weight 172.025 g/mol
Number of Peaks 46
RI1 1294
SMILES Nc1ccc(cc1)Br
SPLASH splash10-00di-9700000000-3b5c6b93c58fb814b364
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-bromo-
Wiley ID LM_PEST_853