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Diethyl hydroxy(3-nitrophenyl)methylphosphonate
SpectraBase Compound ID Aa6V5aTSoOY
InChI InChI=1S/C11H16NO6P/c1-3-17-19(16,18-4-2)11(13)9-6-5-7-10(8-9)12(14)15/h5-8,11,13H,3-4H2,1-2H3
InChIKey XQHANJBMOMOBPM-UHFFFAOYSA-N
Mol Weight 289.22 g/mol
Molecular Formula C11H16NO6P
Exact Mass 289.071524 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4aL4wLjxWi
Name Diethyl hydroxy(3-nitrophenyl)methylphosphonate
Alternate Name(s) .alpha.-Hydroxy-m-nitro-.alpha.-toluenephosphonic acid diethyl ester .alpha.-Toluenephosphonic acid, .alpha.-hydroxy-3-nitro-, diethyl ester .alpha.-Toluenephosphonic acid, .alpha.-hydroxy-m-nitro-, diethyl ester Diethoxyphosphoryl-(3-nitrophenyl)methanol Diethyl (hydroxy(3-nitrophenyl)methyl)phosphonate Phosphonic acid, (hydroxy(3-nitrophenyl)methyl)-, diethyl ester Phosphonic acid, hydroxy(3-nitrophenyl)methyl-, diethyl ester Phosphonic acid, (hydroxy)(3-nitrophenyl)methyl-, diethyl ester AI3-17795 BRN 2596653 NSC 43451
CAS Registry Number 50652-91-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16NO6P
InChI InChI=1S/C11H16NO6P/c1-3-17-19(16,18-4-2)11(13)9-6-5-7-10(8-9)12(14)15/h5-8,11,13H,3-4H2,1-2H3
InChIKey XQHANJBMOMOBPM-UHFFFAOYSA-N
Molecular Weight 289.224 g/mol
SMILES OC(P(OCC)(=O)OCC)c1cccc(c1)[N+]([O-])=O
SPLASH splash10-0udi-9500000000-6e650692202266173c9b
Source of Spectrum JX-2015-2-1229
Wiley ID 1722888