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2',3',5'-tri-O-acetyl-2-fluoroadenosine
SpectraBase Compound ID AY7kdwkob9t
InChI InChI=1S/C16H18FN5O7/c1-6(23)26-4-9-11(27-7(2)24)12(28-8(3)25)15(29-9)22-5-19-10-13(18)20-16(17)21-14(10)22/h5,9,11-12,15H,4H2,1-3H3,(H2,18,20,21)
InChIKey LDICZLRLPNWOIS-UHFFFAOYSA-N
Mol Weight 411.35 g/mol
Molecular Formula C16H18FN5O7
Exact Mass 411.119026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LWckD3ZqtDz
Name 2',3',5'-tri-O-acetyl-2-fluoroadenosine
Alternate Name(s) [3,4-diacetoxy-5-(6-amino-2-fluoro-purin-9-yl)tetrahydrofuran-2-yl]methyl acetate [3,4-diacetyloxy-5-(6-amino-2-fluoropurin-9-yl)oxolan-2-yl]methyl acetate [3,4-diacetyloxy-5-(6-azanyl-2-fluoranyl-purin-9-yl)oxolan-2-yl]methyl ethanoate Acetic acid [3,4-diacetyloxy-5-(6-amino-2-fluoro-9-purinyl)-2-oxolanyl]methyl ester
CAS Registry Number 15811-32-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18FN5O7
InChI InChI=1S/C16H18FN5O7/c1-6(23)26-4-9-11(27-7(2)24)12(28-8(3)25)15(29-9)22-5-19-10-13(18)20-16(17)21-14(10)22/h5,9,11-12,15H,4H2,1-3H3,(H2,18,20,21)
InChIKey LDICZLRLPNWOIS-UHFFFAOYSA-N
Molecular Weight 411.346 g/mol
SMILES Nc1c2c([n](C3OC(COC(C)=O)C(C3OC(C)=O)OC(C)=O)cn2)nc(n1)F
SPLASH splash10-0a4i-0390100000-1c7e09196a3c551fdc38
Source of Spectrum I-59-2610-0
Wiley ID 1374000