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Ethyl 4-[6-Iodo-9-(methoxymethyl)-9H-purin-8-yl]benzoate
SpectraBase Compound ID JwAo69Y7us0
InChI InChI=1S/C16H15IN4O3/c1-3-24-16(22)11-6-4-10(5-7-11)14-20-12-13(17)18-8-19-15(12)21(14)9-23-2/h4-8H,3,9H2,1-2H3
InChIKey JNOOBMQBXPROAH-UHFFFAOYSA-N
Mol Weight 438.23 g/mol
Molecular Formula C16H15IN4O3
Exact Mass 438.018885 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3kIQBLOEfJJ
Name Ethyl 4-[6-Iodo-9-(methoxymethyl)-9H-purin-8-yl]benzoate
Alternate Name(s) Ethyl 4-(6-iodo-9-(methoxymethyl)-9H-purin-8-yl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15IN4O3
InChI InChI=1S/C16H15IN4O3/c1-3-24-16(22)11-6-4-10(5-7-11)14-20-12-13(17)18-8-19-15(12)21(14)9-23-2/h4-8H,3,9H2,1-2H3
InChIKey JNOOBMQBXPROAH-UHFFFAOYSA-N
Molecular Weight 438.225 g/mol
SMILES c1([n](c2c(n1)c(ncn2)I)COC)-c1ccc(C(=O)OCC)cc1
SPLASH splash10-0a4i-3029400000-b6e1a73db10547812af8
Source of Spectrum F4-45-3035-7a
Wiley ID 1741857