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Adenosine, 5'-deoxy-5'-(phosphonoamino)-, bis(2,2,2-trichloroethyl) ester
SpectraBase Compound ID CuVZgpcovxn
InChI InChI=1S/C14H17Cl6N6O6P/c15-13(16,17)2-30-33(29,31-3-14(18,19)20)25-1-6-8(27)9(28)12(32-6)26-5-24-7-10(21)22-4-23-11(7)26/h4-6,8-9,12,27-28H,1-3H2,(H,25,29)(H2,21,22,23)
InChIKey MZROWXZHZQQEJJ-UHFFFAOYSA-N
Mol Weight 609.0 g/mol
Molecular Formula C14H17Cl6N6O6P
Exact Mass 605.907835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKSr7yKnGQ2
Name Adenosine, 5'-deoxy-5'-(phosphonoamino)-, bis(2,2,2-trichloroethyl) ester
CAS Registry Number 25254-10-8
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17Cl6N6O6P
InChI InChI=1S/C14H17Cl6N6O6P/c15-13(16,17)2-30-33(29,31-3-14(18,19)20)25-1-6-8(27)9(28)12(32-6)26-5-24-7-10(21)22-4-23-11(7)26/h4-6,8-9,12,27-28H,1-3H2,(H,25,29)(H2,21,22,23)
InChIKey MZROWXZHZQQEJJ-UHFFFAOYSA-N
Molecular Weight 609.018 g/mol
SMILES N(CC1C(C(C(O1)[n]1cnc2c(N)ncnc12)O)O)P(=O)(OCC(Cl)(Cl)Cl)OCC(Cl)(Cl)Cl
SPLASH splash10-000i-3920000000-de6517c84fe92d12f48f
Source of Spectrum AD-0-3494-0
Synonyms 2-(6-aminopurin-9-yl)-5-[[bis(2,2,2-trichloroethoxy)phosphorylamino]methyl]oxolane-3,4-diol 2-(6-aminopurin-9-yl)-5-[[bis(2,2,2-trichloroethoxy)phosphorylamino]methyl]tetrahydrofuran-3,4-diol 2-(6-aminopurin-9-yl)-5-[[bis[2,2,2-tris(chloranyl)ethoxy]phosphorylamino]methyl]oxolane-3,4-diol 2-Adenin-9-yl-5-[[bis(2,2,2-trichloroethoxy)phosphorylamino]methyl]tetrahydrofuran-3,4-diol
Wiley ID 65328