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D-Mannonic acid, 6-bromo-6-deoxy-2,3,4-tris-O-(phenylmethyl)-, .delta.-lactone
SpectraBase Compound ID 3QNSUGafBbU
InChI InChI=1S/C27H27BrO5/c28-16-23-24(30-17-20-10-4-1-5-11-20)25(31-18-21-12-6-2-7-13-21)26(27(29)33-23)32-19-22-14-8-3-9-15-22/h1-15,23-26H,16-19H2/t23-,24-,25+,26+/m1/s1
InChIKey VKORRCWJMPLIFQ-XPGKHFPBSA-N
Mol Weight 511.41 g/mol
Molecular Formula C27H27BrO5
Exact Mass 510.104187 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DwDiPZ9ltgU
Name D-Mannonic acid, 6-bromo-6-deoxy-2,3,4-tris-O-(phenylmethyl)-, .delta.-lactone
Alternate Name(s) (3S,4S,5S,6S)-3,4,5-tris(benzyloxy)-6-(bromomethyl)oxan-2-one 2,3,4-tri-O-benzyl-6-bromo-6-deoxy-D-mannono-1,5-lactone
CAS Registry Number 93286-38-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H27BrO5
InChI InChI=1S/C27H27BrO5/c28-16-23-24(30-17-20-10-4-1-5-11-20)25(31-18-21-12-6-2-7-13-21)26(27(29)33-23)32-19-22-14-8-3-9-15-22/h1-15,23-26H,16-19H2/t23-,24-,25+,26+/m1/s1
InChIKey VKORRCWJMPLIFQ-XPGKHFPBSA-N
Molecular Weight 511.412 g/mol
SMILES [C@]1([C@]([C@](OCc2ccccc2)([C@](OC1=O)(CBr)[H])[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H]
SPLASH splash10-0006-9200000000-2865d4f25bc03b5d15e3
Source of Spectrum H-67-1339-0
Wiley ID 1400482