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(7R*,8R*)-7,8-Dihydro-7-iodomethyl-8-methyl-6-phenylimidazo[2,1-b]pteridin-10(6H)-one
SpectraBase Compound ID 44Azx4i8WeH
InChI InChI=1S/C16H14IN5O/c1-10-12(9-17)22(11-5-3-2-4-6-11)16-20-14-13(15(23)21(10)16)18-7-8-19-14/h2-8,10,12H,9H2,1H3/t10-,12+/m1/s1
InChIKey ZBIKOYPJIJPEID-PWSUYJOCSA-N
Mol Weight 419.23 g/mol
Molecular Formula C16H14IN5O
Exact Mass 419.024305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2qNX1gBbUy
Name (7R*,8R*)-7,8-Dihydro-7-iodomethyl-8-methyl-6-phenylimidazo[2,1-b]pteridin-10(6H)-one
Alternate Name(s) (7R,8R)-7-(iodomethyl)-8-methyl-6-phenyl-7,8-dihydroimidazo[2,1-b]pteridin-10(6H)-one (7R,8R)-7-(iodanylmethyl)-8-methyl-6-phenyl-7,8-dihydroimidazo[2,1-b]pteridin-10-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14IN5O
InChI InChI=1S/C16H14IN5O/c1-10-12(9-17)22(11-5-3-2-4-6-11)16-20-14-13(15(23)21(10)16)18-7-8-19-14/h2-8,10,12H,9H2,1H3/t10-,12+/m1/s1
InChIKey ZBIKOYPJIJPEID-PWSUYJOCSA-N
Molecular Weight 419.226 g/mol
SMILES C1=2N(C(c3c(N2)nccn3)=O)[C@@]([C@@](N1c1ccccc1)(CI)[H])(C)[H]
SPLASH splash10-0006-0090100000-9571e7b7246ca86174eb
Source of Spectrum KC-0-2284-12
Wiley ID 825896