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D-MANNOFURANOSYL-THEOPHYLLINE
SpectraBase Compound ID 2hBReFI2LYB
InChI InChI=1S/C13H18N4O7/c1-15-10-6(11(22)16(2)13(15)23)14-4-17(10)12-8(21)7(20)9(24-12)5(19)3-18/h4-5,7-9,12,18-21H,3H2,1-2H3
InChIKey JJNNVGWKMVEREL-UHFFFAOYSA-N
Mol Weight 342.31 g/mol
Molecular Formula C13H18N4O7
Exact Mass 342.117549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lq9HEH1heym
Name D-MANNOFURANOSYL-THEOPHYLLINE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H18O7N4
InChI InChI=1S/C13H18N4O7/c1-15-10-6(11(22)16(2)13(15)23)14-4-17(10)12-8(21)7(20)9(24-12)5(19)3-18/h4-5,7-9,12,18-21H,3H2,1-2H3
InChIKey JJNNVGWKMVEREL-UHFFFAOYSA-N
Instrument Name CH5
Molecular Weight 342.1171
SMILES OCC(C1C(C(O)C(O1)[n]1cnc2C(=O)N(C)C(=O)N(C)c12)O)O
SPLASH splash10-001i-6900000000-1b18cec84551cf412ef7
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany