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3,6-bis(Methoxycarbonyl)-4-(.beta.-D-ribofuranosyl)-5-pentylpyridazine
SpectraBase Compound ID 6phAjfq0uix
InChI InChI=1S/C18H26N2O8/c1-4-5-6-7-9-11(16-15(23)14(22)10(8-21)28-16)13(18(25)27-3)20-19-12(9)17(24)26-2/h10,14-16,21-23H,4-8H2,1-3H3/t10-,14-,15-,16+/m1/s1
InChIKey CRIHRSFPOLFUMO-KCXZSRPNSA-N
Mol Weight 398.41 g/mol
Molecular Formula C18H26N2O8
Exact Mass 398.168916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdYHmmiL3XX
Name 3,6-bis(Methoxycarbonyl)-4-(.beta.-D-ribofuranosyl)-5-pentylpyridazine
Alternate Name(s) 3,6-dimethyl 4-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-pentylpyridazine-3,6-dicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C18H26N2O8
InChI InChI=1S/C18H26N2O8/c1-4-5-6-7-9-11(16-15(23)14(22)10(8-21)28-16)13(18(25)27-3)20-19-12(9)17(24)26-2/h10,14-16,21-23H,4-8H2,1-3H3/t10-,14-,15-,16+/m1/s1
InChIKey CRIHRSFPOLFUMO-KCXZSRPNSA-N
Molecular Weight 398.412 g/mol
SMILES O[C@@]1([C@@]([C@@](CO)(O[C@]1(c1c(nnc(c1CCCCC)C(=O)OC)C(=O)OC)[H])[H])(O)[H])[H]
SPLASH splash10-0udi-0091000000-75943357f81a554f305d
Source of Spectrum D8-327-370-13
Wiley ID 1515302