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3-Bromoaniline

View entire compound with spectra: 16 NMR, 7 FTIR, 1 Raman, 8 MS (GC), and 2 Near IR

3-Bromoaniline
SpectraBase Compound ID DDEJfKp28sc
InChI InChI=1S/C6H6BrN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2
InChIKey DHYHYLGCQVVLOQ-UHFFFAOYSA-N
Mol Weight 172.03 g/mol
Molecular Formula C6H6BrN
Exact Mass 170.968362 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JqYnOE3Zxf1
Name 3-Bromo-aniline
CAS Registry Number 591-19-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H6BrN
InChI InChI=1S/C6H6BrN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2
InChIKey DHYHYLGCQVVLOQ-UHFFFAOYSA-N
Instrument Name Jeol PFT-100
Literature Reference J. Bromilow, R.T. Brownlee, D.J. Craik, M.Sadek, Magn. Res. Chem. 24, 862 (1986)
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3