1,3-Dioxolo[3,4]cyclopenta[1,2-d][1,3]dioxin, 9H-purine deriv.

SpectraBase Compound ID	Cj1PqPwAWVp
InChI	InChI=1S/C17H21ClN4O6/c1-3-23-16-25-5-8-11(26-16)10(13-12(8)27-17(28-13)24-4-2)22-7-21-9-14(18)19-6-20-15(9)22/h6-8,10-13,16-17H,3-5H2,1-2H3
InChIKey	QGOLFUOXEALQLW-UHFFFAOYSA-N Google Search
Mol Weight	412.83 g/mol
Molecular Formula	C17H21ClN4O6
Exact Mass	412.114962 g/mol

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SpectraBase Spectrum ID	LvQNUSW0eIr
Name	1,3-Dioxolo[3,4]cyclopenta[1,2-d][1,3]dioxin, 9H-purine deriv.
Alternate Name(s)	9H-Purine, 6-chloro-9-(2,6-diethoxyhexahydro-1,3-dioxolo[3,4]cyclopenta[1,2-d][1,3]dioxin-8-yl)- 6-Chloro-9-(2,6-diethoxyhexahydro[1,3]dioxolo[4',5':3,4]cyclopenta[1,2-d][1,3]dioxin-8-yl)-9H-purine
CAS Registry Number	112440-42-3
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H21ClN4O6
InChI	InChI=1S/C17H21ClN4O6/c1-3-23-16-25-5-8-11(26-16)10(13-12(8)27-17(28-13)24-4-2)22-7-21-9-14(18)19-6-20-15(9)22/h6-8,10-13,16-17H,3-5H2,1-2H3
InChIKey	QGOLFUOXEALQLW-UHFFFAOYSA-N
Molecular Weight	412.830 g/mol
SMILES	C1([n]2c3c(c(Cl)ncn3)nc2)C2C(OC(O2)OCC)C2C1OC(OC2)OCC
SPLASH	splash10-0pb9-0931000000-09492a3ad35fee03432f
Source of Spectrum	J-53-936-26
Wiley ID	1374280