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3-DIETHYLPHOSPHONATO-4-PHENYLPYRAZOLO-[3,2-C]-[1,2,4]-TRIAZIN-8-YLCARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID 74xUDlYSDGR
InChI InChI=1S/C18H21N4O5P/c1-4-25-18(23)14-12-19-22-15(13-10-8-7-9-11-13)17(21-20-16(14)22)28(24,26-5-2)27-6-3/h7-12H,4-6H2,1-3H3
InChIKey WYJZPSDCNSZRIH-UHFFFAOYSA-N
Mol Weight 404.36 g/mol
Molecular Formula C18H21N4O5P
Exact Mass 404.124957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cx1pwekMAIT
Name 3-Diethoxyphosphoryl-4-phenyl-8-pyrazolo[5,1-c][1,2,4]triazinecarboxylic acid ethyl ester
Alternate Name(s) 3-Diethoxyphosphoryl-4-phenyl-pyrazolo[5,1-c][1,2,4]triazine-8-carboxylic acid ethyl ester Ethyl 3-diethoxyphosphoryl-4-phenylpyrazolo[5,1-c][1,2,4]triazine-8-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21N4O5P
InChI InChI=1S/C18H21N4O5P/c1-4-25-18(23)14-12-19-22-15(13-10-8-7-9-11-13)17(21-20-16(14)22)28(24,26-5-2)27-6-3/h7-12H,4-6H2,1-3H3
InChIKey WYJZPSDCNSZRIH-UHFFFAOYSA-N
Molecular Weight 404.363 g/mol
SMILES c12[n](ncc2C(=O)OCC)C(=C(N=N1)P(=O)(OCC)OCC)c1ccccc1
SPLASH splash10-0udi-3975400000-17f563dfdf491382f696
Source of Spectrum H1-51-531-11
Wiley ID 816970