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1,4-Benzenediamine
SpectraBase Compound ID IAnC9gW6vVz
InChI InChI=1S/C6H8N2/c7-5-1-2-6(8)4-3-5/h1-4H,7-8H2
InChIKey CBCKQZAAMUWICA-UHFFFAOYSA-N
Mol Weight 108.14 g/mol
Molecular Formula C6H8N2
Exact Mass 108.068748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LYf768iDk6t
Name 1,4-Benzenediamine @
CAS Registry Number 106-50-3
Classification Hair dye Chemical
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 108.068748266 u
Formula C6H8N2
InChI InChI=1S/C6H8N2/c7-5-1-2-6(8)4-3-5/h1-4H,7-8H2
InChIKey CBCKQZAAMUWICA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 108.144 g/mol
SMILES c1(N)ccc(N)cc1
SPLASH splash10-0a4i-8900000000-3a22e72e4154942240b6
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: G
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms p-Phenylenediamine p-Phenylenediamine
Technique GC/MS
Wiley ID MMPW6e_5330