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2'-Deoxy-3'-O-butoylriboseadenine
SpectraBase Compound ID 8GTpd2aYySq
InChI InChI=1S/C14H19N5O4/c1-2-3-11(21)23-8-4-10(22-9(8)5-20)19-7-18-12-13(15)16-6-17-14(12)19/h6-10,20H,2-5H2,1H3,(H2,15,16,17)/t8-,9-,10-/m1/s1
InChIKey QMHFITRFEYPFET-OPRDCNLKSA-N
Mol Weight 321.34 g/mol
Molecular Formula C14H19N5O4
Exact Mass 321.143704 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F20MoFNNP2C
Name 2'-Deoxy-3'-O-butoylriboseadenine
Comments Less than 3 mono-isotopic peaks
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Formula C14H19N5O4
InChI InChI=1S/C14H19N5O4/c1-2-3-11(21)23-8-4-10(22-9(8)5-20)19-7-18-12-13(15)16-6-17-14(12)19/h6-10,20H,2-5H2,1H3,(H2,15,16,17)/t8-,9-,10-/m1/s1
InChIKey QMHFITRFEYPFET-OPRDCNLKSA-N
Molecular Weight 321.337 g/mol
SMILES Nc1c2c([n]([C@@]3(O[C@](CO)([C@@](C3)(OC(=O)CCC)[H])[H])[H])cn2)ncn1
SPLASH splash10-000i-0900000000-85195870cc70f5729bc5
Source of Spectrum SO-0-626-3
Wiley ID 1543349