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4-Nitrophenyl phosphate
SpectraBase Compound ID HF6ZFKftlhz
InChI InChI=1S/C6H6NO6P/c8-7(9)5-1-3-6(4-2-5)13-14(10,11)12/h1-4H,(H2,10,11,12)
InChIKey XZKIHKMTEMTJQX-UHFFFAOYSA-N
Mol Weight 219.09 g/mol
Molecular Formula C6H6NO6P
Exact Mass 218.993274 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DLvoRaotzv7
Name 4-Nitrophenyl phosphate
Acquisition Mode SIMULTANEOUS
CAS Registry Number 32348-90-6 4264-83-9 330-13-2 54306-27-3 32348-91-7
ChEBI ID 17440
Comments mM 4-Nitrophenyl phosphate - CAL Biochem 30139; 100 % D2O 50 mM sodium phosphate 500 uM sodium azide 500 uM DSS - pH 7.4, temperature 298 K
Copyright Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Source Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Mark E. Anderson, John L. Markley.
Formula C6 H6 N O6 P
IUPAC Name (4-nitrophenoxy)phosphonic acid
InChI InChI=1S/C6H6NO6P/c8-7(9)5-1-3-6(4-2-5)13-14(10,11)12/h1-4H,(H2,10,11,12)
InChIKey XZKIHKMTEMTJQX-UHFFFAOYSA-N
KEGG Compound ID C03360
KEGG Pathways PATH: map00361 gamma-Hexachlorocyclohexane degradation
PubChem Compound ID 378
SMILES C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(O)O
Source File Reference bmse000264