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1-Nitro-2-phenylethane
SpectraBase Compound ID EdA4UiHY1pR
InChI InChI=1S/C8H9NO2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey XAWCLWKTUKMCMO-UHFFFAOYSA-N
Mol Weight 151.16 g/mol
Molecular Formula C8H9NO2
Exact Mass 151.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GEijetFZYWI
Name Phenyl ethane<1-nitro-2->
CAS Registry Number 6125-24-2
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 151.063328532 u
Formula C8H9NO2
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/C8H9NO2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey XAWCLWKTUKMCMO-UHFFFAOYSA-N
Molecular Weight 151.165 g/mol
Nominal Mass 151 u
Number of Peaks 82
SMILES c1cc(ccc1)CCN(=O)=O
SPLASH splash10-0ufr-9800000000-6f13641446a8ab292ff3
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001091