1,5-Dioxaspiro[5.5]undecane, 9H-purin-2-amine deriv.

SpectraBase Compound ID	3aEUZrdpmtw
InChI	InChI=1S/C23H28ClN5O3/c24-20-19-21(28-22(25)27-20)29(15-26-19)11-18(30-12-16-7-3-1-4-8-16)17-13-31-23(32-14-17)9-5-2-6-10-23/h1,3-4,7-8,15,17-18H,2,5-6,9-14H2,(H2,25,27,28)
InChIKey	BKPIGNBIAGOUGY-UHFFFAOYSA-N Google Search
Mol Weight	457.96 g/mol
Molecular Formula	C23H28ClN5O3
Exact Mass	457.188067 g/mol

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SpectraBase Spectrum ID	K1tGzhNFnNT
Name	1,5-Dioxaspiro[5.5]undecane, 9H-purin-2-amine deriv.
Alternate Name(s)	9H-Purin-2-amine, 6-chloro-9-[2-(1,5-dioxaspiro[5.5]undec-3-yl)-2-(phenylmethoxy)ethyl]- 2-Amino-9-{2-benzyloxy-2-(1,5-dioxaspiro[5.5]undecan-3-yl)ethyl}-6-chloropurine 9-[2-(benzyloxy)-2-(1,5-dioxaspiro[5.5]undec-3-yl)ethyl]-6-chloro-9H-purin-2-amine 9-[2-(benzyloxy)-2-(1,5-dioxaspiro[5.5]undec-3-yl)ethyl]-6-chloro-9H-purin-2-ylamine
CAS Registry Number	119117-62-3
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C23H28ClN5O3
InChI	InChI=1S/C23H28ClN5O3/c24-20-19-21(28-22(25)27-20)29(15-26-19)11-18(30-12-16-7-3-1-4-8-16)17-13-31-23(32-14-17)9-5-2-6-10-23/h1,3-4,7-8,15,17-18H,2,5-6,9-14H2,(H2,25,27,28)
InChIKey	BKPIGNBIAGOUGY-UHFFFAOYSA-N
Molecular Weight	457.962 g/mol
SMILES	Nc1nc(c2c([n](cn2)CC(C2COC3(OC2)CCCCC3)OCc2ccccc2)n1)Cl
SPLASH	splash10-0006-9101500000-17f6765d742388706717
Source of Spectrum	KC-1988-2762-11
Wiley ID	1389613