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D-RIBITOL, 1,4-ANHYDRO-1-C-(2,6-DIAMINO-3-PYRIDINYL)-2,3-O-(1-METHYLETHYLIDENE)-, (1S)-
SpectraBase Compound ID 1xuTUrn2MJ4
InChI InChI=1S/C13H19N3O4/c1-13(2)19-10-7(5-17)18-9(11(10)20-13)6-3-4-8(14)16-12(6)15/h3-4,7,9-11,17H,5H2,1-2H3,(H4,14,15,16)
InChIKey KOLMOHMFEXUSBT-UHFFFAOYSA-N
Mol Weight 281.31 g/mol
Molecular Formula C13H19N3O4
Exact Mass 281.137556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8bbqP3O4oIP
Name D-RIBITOL, 1,4-ANHYDRO-1-C-(2,6-DIAMINO-3-PYRIDINYL)-2,3-O-(1-METHYLETHYLIDENE)-, (1S)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H19N3O4
InChI InChI=1S/C13H19N3O4/c1-13(2)19-10-7(5-17)18-9(11(10)20-13)6-3-4-8(14)16-12(6)15/h3-4,7,9-11,17H,5H2,1-2H3,(H4,14,15,16)
InChIKey KOLMOHMFEXUSBT-UHFFFAOYSA-N
Molecular Weight 281.1371
SMILES Nc1c(C2C3OC(OC3C(CO)O2)(C)C)ccc(n1)N
SPLASH splash10-053i-4930000000-ce51245cefd3f7152ae6
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany