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[(2S,5R)-5-[6-(ethoxycarbonylamino)purin-9-yl]oxolan-2-yl]methyl ethyl carbonate
SpectraBase Compound ID EqDUwo2FJSV
InChI InChI=1S/C16H21N5O6/c1-3-24-15(22)20-13-12-14(18-8-17-13)21(9-19-12)11-6-5-10(27-11)7-26-16(23)25-4-2/h8-11H,3-7H2,1-2H3,(H,17,18,20,22)/t10-,11+/m0/s1
InChIKey BVFVKLMNORWPFU-WDEREUQCSA-N
Mol Weight 379.37 g/mol
Molecular Formula C16H21N5O6
Exact Mass 379.149183 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Be5c2agVLnI
Name [(2S,5R)-5-[6-(ethoxycarbonylamino)purin-9-yl]oxolan-2-yl]methyl ethyl carbonate
Alternate Name(s) [(2S,5R)-5-[6-(ethoxycarbonylamino)purin-9-yl]tetrahydrofuran-2-yl]methyl ethyl carbonate Carbonic acid [(2S,5R)-5-[6-(ethoxycarbonylamino)-9-purinyl]-2-oxolanyl]methyl ethyl ester
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Formula C16H21N5O6
InChI InChI=1S/C16H21N5O6/c1-3-24-15(22)20-13-12-14(18-8-17-13)21(9-19-12)11-6-5-10(27-11)7-26-16(23)25-4-2/h8-11H,3-7H2,1-2H3,(H,17,18,20,22)/t10-,11+/m0/s1
InChIKey BVFVKLMNORWPFU-WDEREUQCSA-N
Molecular Weight 379.373 g/mol
SMILES N(c1c2c([n](cn2)[C@@]2(O[C@](COC(=O)OCC)(CC2)[H])[H])ncn1)C(=O)OCC
SPLASH splash10-003r-0059000000-b072fdcff51a3fe39c2d
Source of Spectrum SB-50-616-11
Wiley ID 1359182