| SpectraBase Spectrum ID |
LBBu2JcbmF1 |
| Name |
2-Amino-5-cyano-6-(4'-chlorophenyl)-4-oxo-4H-pyran-3-ylphosphonic acid ethyl ester |
| Comments |
Note: The molecular formula of the structure shown is C14H12ClN2O5P - which differs from the formula reported for the mass spectrum (C20H16ClN2O4P) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H16ClN2O4P |
| InChI |
InChI=1S/C14H12ClN2O5P/c1-2-21-23(19,20)13-11(18)10(7-16)12(22-14(13)17)8-3-5-9(15)6-4-8/h3-6H,2,17H2,1H3,(H,19,20) |
| InChIKey |
HRRUBVOZNGGCGP-UHFFFAOYSA-N |
| Molecular Weight |
354.686 g/mol |
| SMILES |
OP(C1=C(OC(=C(C1=O)C#N)c1ccc(cc1)Cl)N)(OCC)=O |
| SPLASH |
splash10-004i-9200100000-029437b4f043969556cf |
| Source of Spectrum |
H1-47-260-9 |
| Wiley ID |
816124 |
