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Penta-O-acetyl.beta.-D-glucopyranoside
SpectraBase Compound ID 1OH2XLtfxXp
InChI InChI=1S/C16H22O11/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(27-12)26-11(5)21/h12-16H,6H2,1-5H3
InChIKey LPTITAGPBXDDGR-UHFFFAOYSA-N
Mol Weight 390.34 g/mol
Molecular Formula C16H22O11
Exact Mass 390.116212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8cA510Nl9ij
Name .alpha.-D-Glucopyranose, pentaacetate
CAS Registry Number 604-68-2
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 390.116211517 u
Formula C16H22O11
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C16H22O11/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(27-12)26-11(5)21/h12-16H,6H2,1-5H3
InChIKey LPTITAGPBXDDGR-UHFFFAOYSA-N
Molecular Weight 390.341 g/mol
Nominal Mass 390 u
Number of Peaks 172
SMILES C1(OC(C(C(C1OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)COC(=O)C
SPLASH splash10-00kf-7920000000-71abde942f5639968b29
Source S. Witkowski
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI001065