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Indole
SpectraBase Compound ID BGv5NPMT2gH
InChI InChI=1S/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9H
InChIKey SIKJAQJRHWYJAI-UHFFFAOYSA-N
Mol Weight 117.15 g/mol
Molecular Formula C8H7N
Exact Mass 117.057849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AfLA12O43jr
Name Indole
CAS Registry Number 120-72-9
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 117.057849229 u
Formula C8H7N
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9H
InChIKey SIKJAQJRHWYJAI-UHFFFAOYSA-N
Molecular Weight 117.151 g/mol
Nominal Mass 117 u
Number of Peaks 70
SMILES [nH]1ccc2c1cccc2
SPLASH splash10-014i-9700000000-fd10758283ab3d0b15ec
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA000708