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1,2,3,4,5-Penta-O-acetylhex-2-ulopyranose
SpectraBase Compound ID IorZPrcajlR
InChI InChI=1S/C16H22O11/c1-8(17)22-7-16(27-12(5)21)15(26-11(4)20)14(25-10(3)19)13(6-23-16)24-9(2)18/h13-15H,6-7H2,1-5H3/t13-,14+,15+,16+/m1/s1
InChIKey JTQZPXRNYVFCJI-UGUYLWEFSA-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 FlQECFj1Oho
Name 1,2,3,4,5-Penta-O-acetylhex-2-ulopyranose
CAS Registry Number 114421-67-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O11
InChI InChI=1S/C16H22O11/c1-8(17)22-7-16(27-12(5)21)15(26-11(4)20)14(25-10(3)19)13(6-23-16)24-9(2)18/h13-15H,6-7H2,1-5H3/t13-,14+,15+,16+/m1/s1
InChIKey JTQZPXRNYVFCJI-UGUYLWEFSA-N
Molecular Weight 390.341 g/mol
SMILES [C@]1([C@]([C@@](OC(=O)C)([C@@](CO1)(OC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)COC(=O)C
SPLASH splash10-006x-7901000000-2884e772c4313ee62bf2
Source of Spectrum O-22-554-3
Wiley ID 1364572