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9-[3'-(Benzoyloxy)-2'-fluoropropyl]adenine
SpectraBase Compound ID 5BgzRkc7rMT
InChI InChI=1S/C15H14FN5O2/c16-11(7-23-15(22)10-4-2-1-3-5-10)6-21-9-20-12-13(17)18-8-19-14(12)21/h1-5,8-9,11H,6-7H2,(H2,17,18,19)
InChIKey BZBSHSJLISEPHR-UHFFFAOYSA-N
Mol Weight 315.31 g/mol
Molecular Formula C15H14FN5O2
Exact Mass 315.113153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5w2fY3n6fIp
Name 9-[3'-(Benzoyloxy)-2'-fluoropropyl]adenine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14FN5O2
InChI InChI=1S/C15H14FN5O2/c16-11(7-23-15(22)10-4-2-1-3-5-10)6-21-9-20-12-13(17)18-8-19-14(12)21/h1-5,8-9,11H,6-7H2,(H2,17,18,19)
InChIKey BZBSHSJLISEPHR-UHFFFAOYSA-N
Molecular Weight 315.308 g/mol
SMILES Nc1c2c([n](cn2)CC(COC(=O)c2ccccc2)F)ncn1
SPLASH splash10-0c03-1921000000-4516d3eccb56e15b236d
Source of Spectrum G-57-1479-0
Synonyms 3-(6-amino-9H-purin-9-yl)-2-fluoropropyl benzoate
Wiley ID 813227