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(Z)-2-Amino-6-chloro-N(9)-(4-(diethylphosphono)-2-buten-1-yl)purine
SpectraBase Compound ID GLOvjEjQxlz
InChI InChI=1S/C13H19ClN5O3P/c1-3-21-23(20,22-4-2)8-6-5-7-19-9-16-10-11(14)17-13(15)18-12(10)19/h5-6,9H,3-4,7-8H2,1-2H3,(H2,15,17,18)/b6-5-
InChIKey JCHBJGWWYCFCTR-WAYWQWQTSA-N
Mol Weight 359.75 g/mol
Molecular Formula C13H19ClN5O3P
Exact Mass 359.091404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BkjzWmg32l0
Name (Z)-2-Amino-6-chloro-N(9)-(4-(diethylphosphono)-2-buten-1-yl)purine
CAS Registry Number 135878-74-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19ClN5O3P
InChI InChI=1S/C13H19ClN5O3P/c1-3-21-23(20,22-4-2)8-6-5-7-19-9-16-10-11(14)17-13(15)18-12(10)19/h5-6,9H,3-4,7-8H2,1-2H3,(H2,15,17,18)/b6-5-
InChIKey JCHBJGWWYCFCTR-WAYWQWQTSA-N
Molecular Weight 359.754 g/mol
SMILES Nc1nc(c2c(n1)[n](cn2)C\C=C/CP(=O)(OCC)OCC)Cl
SPLASH splash10-0ap0-0943000000-0ff373b504c66420c2ca
Source of Spectrum J-57-2325-17
Synonyms Diethyl (2Z)-4-(2-amino-6-chloro-9H-purin-9-yl)-2-butenylphosphonate
Wiley ID 1347623