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.alpha.-D-Allofuranose, 5-deoxy-1,2-O-(1-methylethylidene)-5-(nitromethyl)-3-O-(phenylmethyl)-, 6-benzoate
SpectraBase Compound ID BDCNx26fooO
InChI InChI=1S/C24H27NO8/c1-24(2)32-21-20(29-14-16-9-5-3-6-10-16)19(31-23(21)33-24)18(13-25(27)28)15-30-22(26)17-11-7-4-8-12-17/h3-12,18-21,23H,13-15H2,1-2H3/t18-,19-,20-,21-,23-/m1/s1
InChIKey ONTCNHQDVXOXML-XARADAHVSA-N
Mol Weight 457.48 g/mol
Molecular Formula C24H27NO8
Exact Mass 457.173667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tKWzCN8gQe
Name .alpha.-D-Allofuranose, 5-deoxy-1,2-O-(1-methylethylidene)-5-(nitromethyl)-3-O-(phenylmethyl)-, 6-benzoate
CAS Registry Number 131682-06-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H27NO8
InChI InChI=1S/C24H27NO8/c1-24(2)32-21-20(29-14-16-9-5-3-6-10-16)19(31-23(21)33-24)18(13-25(27)28)15-30-22(26)17-11-7-4-8-12-17/h3-12,18-21,23H,13-15H2,1-2H3/t18-,19-,20-,21-,23-/m1/s1
InChIKey ONTCNHQDVXOXML-XARADAHVSA-N
Molecular Weight 457.479 g/mol
SMILES [C@]12([C@](O[C@@]([C@]2(OCc2ccccc2)[H])([C@](CN(=O)=O)(COC(=O)c2ccccc2)[H])[H])(OC(O1)(C)C)[H])[H]
SPLASH splash10-052f-9500000000-2816670134b5afb893ae
Source of Spectrum F-46-7465-8
Synonyms Furo[2,3-d]-1,3-dioxole, .alpha.-D-allofuranose deriv. 2,3-Di-O-isopropylidene-4-benzyloxy-5-[1'-benzoyloxymethyl-1'-nitromethyl]]methyl-2,3,4,5-tetrahydrofuran 6-O-benzoyl-3-O-benzyl-5-deoxy-1,2-O-(1-methylethylidene)-5-(nitromethyl)-.alpha.-D-allofuranose
Wiley ID 1389620