For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
8-IODO-7-METHYL-4-PHENYLPYRAZOLO-[3,2-C]-[1,2,4]-TRIAZIN-3-YL-PHOSPHONIC-ACID-DIETHYLESTER
SpectraBase Compound ID 40uMymcZBc6
InChI InChI=1S/C16H18IN4O3P/c1-4-23-25(22,24-5-2)16-14(12-9-7-6-8-10-12)21-15(18-19-16)13(17)11(3)20-21/h6-10H,4-5H2,1-3H3
InChIKey CTZUVXPBCWEHIN-UHFFFAOYSA-N
Mol Weight 472.22 g/mol
Molecular Formula C16H18IN4O3P
Exact Mass 472.016122 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID E98wQ8nzlP4
Name 3-Diethoxyphosphoryl-8-iodanyl-7-methyl-4-phenyl-pyrazolo[5,1-c][1,2,4]triazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18IN4O3P
InChI InChI=1S/C16H18IN4O3P/c1-4-23-25(22,24-5-2)16-14(12-9-7-6-8-10-12)21-15(18-19-16)13(17)11(3)20-21/h6-10H,4-5H2,1-3H3
InChIKey CTZUVXPBCWEHIN-UHFFFAOYSA-N
Molecular Weight 472.223 g/mol
SMILES c12[n](C(c3ccccc3)=C(N=N1)P(=O)(OCC)OCC)nc(c2I)C
SPLASH splash10-03mi-8859800000-04d80c1be657301f120a
Source of Spectrum H1-51-541-20
Synonyms 3-Diethoxyphosphoryl-8-iodo-7-methyl-4-phenyl-pyrazolo[5,1-c][1,2,4]triazine
Wiley ID 817091