9H-Purin-2-amine, 6-chloro-9-[2-[2,2-dimethyl-5-[(phenylmethoxy)methyl]-1,3-dioxan-5-yl]ethyl]-

SpectraBase Compound ID	CmDeG7ZAi6B
InChI	InChI=1S/C21H26ClN5O3/c1-20(2)29-12-21(13-30-20,11-28-10-15-6-4-3-5-7-15)8-9-27-14-24-16-17(22)25-19(23)26-18(16)27/h3-7,14H,8-13H2,1-2H3,(H2,23,25,26)
InChIKey	FIDIVEKJEJDRJS-UHFFFAOYSA-N Google Search
Mol Weight	431.92 g/mol
Molecular Formula	C21H26ClN5O3
Exact Mass	431.172417 g/mol

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SpectraBase Spectrum ID	2dHZHvKJh7R
Name	9H-Purin-2-amine, 6-chloro-9-[2-[2,2-dimethyl-5-[(phenylmethoxy)methyl]-1,3-dioxan-5-yl]ethyl]-
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	431.172417414 u
Formula	C21H26ClN5O3
InChI	InChI=1S/C21H26ClN5O3/c1-20(2)29-12-21(13-30-20,11-28-10-15-6-4-3-5-7-15)8-9-27-14-24-16-17(22)25-19(23)26-18(16)27/h3-7,14H,8-13H2,1-2H3,(H2,23,25,26)
InChIKey	FIDIVEKJEJDRJS-UHFFFAOYSA-N
Molecular Weight	431.924 g/mol
SMILES	C=12C(N=CN2CCC2(COC(OC2)(C)C)COCC2=CC=CC=C2)=C(Cl)N=C(N1)N