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Aniline
SpectraBase Compound ID 9FL0xrOOhtm
InChI InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2
InChIKey PAYRUJLWNCNPSJ-UHFFFAOYSA-N
Mol Weight 93.13 g/mol
Molecular Formula C6H7N
Exact Mass 93.057849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9bDYDrlJgJ
Name Aniline
CAS Registry Number 62-53-3
Classification Chemical
Comments Original RI info: <1000
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 93.057849229 u
Formula C6H7N
InChI InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2
InChIKey PAYRUJLWNCNPSJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 93.129 g/mol
SMILES c1cc(ccc1)N
SPLASH splash10-0006-9000000000-9d54a97d6dc7019e8eed
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.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_1550