Benzene, 1-ethoxy-3-nitro-

Formula: C₈H₉NO₃
Molecular weight: 167.1620
IUPAC Standard InChI: InChI=1S/C8H9NO3/c1-2-12-8-5-3-4-7(6-8)9(10)11/h3-6H,2H2,1H3
IUPAC Standard InChIKey: LFOLBPDHVGDKGJ-UHFFFAOYSA-N
CAS Registry Number: 621-52-3
Chemical structure:
This structure is also available as a 2d Mol file
Other names: Phenetole, m-nitro-; m-Nitrophenetole; 1-Ethoxy-3-nitrobenzene; 3-Nitrophenetole
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Other data available:
- IR Spectrum
- Mass spectrum (electron ionization)
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Gas phase ion energetics data

Data compiled by: Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

Ionization energy determinations

IE (eV)	Method	Reference
9.11 ± 0.15	EI	McLafferty and Schiff, 1969

Appearance energy determinations

Ion	AE (eV)	Other Products	Method	Reference	Comment
C₆H₅NO₃⁺	10.91 ± 0.15	C₂H₄	EI	McLafferty and Schiff, 1969

References

Go To: Top, Gas phase ion energetics data, Notes

McLafferty and Schiff, 1969
McLafferty, F.W.; Schiff, L.J., The structure of [YC₆H₅O]⁺ ions in the spectra of aryl alkyl ethers, Org. Mass Spectrom., 1969, 2, 757. [all data]

Notes

Go To: Top, Gas phase ion energetics data, References

Symbols used in this document:

AE Appearance energy
Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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