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1-Phenyl-1-nitroethane-.beta.-D3
SpectraBase Compound ID JwVX77r160E
InChI InChI=1S/C8H9NO2/c1-7(9(10)11)8-5-3-2-4-6-8/h2-7H,1H3/i1D3
InChIKey GJOVHPKYFFGKCY-FIBGUPNXSA-N
Mol Weight 154.18 g/mol
Molecular Formula C8H6D3NO2
Exact Mass 154.082159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JXKEqyxF3Dd
Name 1-Phenyl-1-nitroethane-.beta.-D3
Alternate Name(s) .beta.-D3-1-phenylnitroethane 1,1,1-Trideuterio-2-nitro-2-phenylethane
CAS Registry Number 23088-44-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6D3NO2
InChI InChI=1S/C8H9NO2/c1-7(9(10)11)8-5-3-2-4-6-8/h2-7H,1H3/i1D3
InChIKey GJOVHPKYFFGKCY-FIBGUPNXSA-N
Molecular Weight 154.183 g/mol
SMILES C(N(=O)=O)(c1ccccc1)C([D])([D])[D]
SPLASH splash10-0a4i-6900000000-8014313e403d4c21f27c
Source of Spectrum O-2-1631-1
Wiley ID 10285