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alpha-D-MANNOPYRANOSYL BROMIDE, 6-DEOXY-6-IODO-, TRIACETATE
SpectraBase Compound ID DYnLNUKoPk0
InChI InChI=1S/C10H14BrIO5.C2H4O2/c1-5(13)15-7-3-8(16-6(2)14)10(11)17-9(7)4-12;1-2(3)4/h7-10H,3-4H2,1-2H3;1H3,(H,3,4)
InChIKey GCGRACKLLJEFFC-UHFFFAOYSA-N
Mol Weight 481.08 g/mol
Molecular Formula C12H18BrIO7
Exact Mass 479.928061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E4Ax0gGQV7O
Name alpha-D-MANNOPYRANOSYL BROMIDE, 6-DEOXY-6-IODO-, TRIACETATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H16O7BrI
InChI InChI=1S/C10H14BrIO5.C2H4O2/c1-5(13)15-7-3-8(16-6(2)14)10(11)17-9(7)4-12;1-2(3)4/h7-10H,3-4H2,1-2H3;1H3,(H,3,4)
InChIKey GCGRACKLLJEFFC-UHFFFAOYSA-N
Molecular Weight 479.9234
SMILES OC(=O)C.C1(Br)C(OC(=O)C)CC(OC(=O)C)C(CI)O1
SPLASH splash10-000f-9652000000-5857b36af7d19552c564
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany