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.alpha.-D-Allofuranose, 3,3'-ethynediylbis[1,2:5,6-bis-O-(1-methylethylidene)-
SpectraBase Compound ID E5eyQWTIVvB
InChI InChI=1S/C26H38O12/c1-21(2)29-11-13(33-21)15-25(27,17-19(31-15)37-23(5,6)35-17)9-10-26(28)16(14-12-30-22(3,4)34-14)32-20-18(26)36-24(7,8)38-20/h13-20,27-28H,11-12H2,1-8H3/t13-,14-,15-,16-,17+,18+,19-,20-,25+,26+/m1/s1
InChIKey ZFXGLAQDSONAOS-YBHNIROCSA-N
Mol Weight 542.6 g/mol
Molecular Formula C26H38O12
Exact Mass 542.236327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZlo408Bqcj
Name .alpha.-D-Allofuranose, 3,3'-ethynediylbis[1,2:5,6-bis-O-(1-methylethylidene)-
CAS Registry Number 35810-61-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38O12
InChI InChI=1S/C26H38O12/c1-21(2)29-11-13(33-21)15-25(27,17-19(31-15)37-23(5,6)35-17)9-10-26(28)16(14-12-30-22(3,4)34-14)32-20-18(26)36-24(7,8)38-20/h13-20,27-28H,11-12H2,1-8H3/t13-,14-,15-,16-,17+,18+,19-,20-,25+,26+/m1/s1
InChIKey ZFXGLAQDSONAOS-YBHNIROCSA-N
Molecular Weight 542.578 g/mol
SMILES O[C@]1(C#C[C@]2([C@@]3([C@@](OC(O3)(C)C)(O[C@@]2([C@@]2(OC(C)(C)OC2)[H])[H])[H])[H])O)[C@@]2([C@@](OC(O2)(C)C)(O[C@@]1([C@@]1(OC(C)(C)OC1)[H])[H])[H])[H]
SPLASH splash10-0f96-9720030000-28d6c3ba8bfe17c62292
Source of Spectrum AU-32-308-3
Synonyms Furo[2,3-d]-1,3-dioxole, .alpha.-D-allofuranose deriv. (3aR,5R,6S,6aR)-6-{2-[(3aR,5R,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-6-hydroxy-2,2-dimethyl-tetrahydro-2H-furo[2,3-d][1,3]dioxol-6-yl]ethynyl}-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-tetrahydro-2H-furo[2,3-d][1,3]dioxol-6-ol 1,2-bis-(1,2:5,6-di-O-isopropylidene-.alpha.-D-allofuranos-3-yl)-acetylene
Wiley ID 64176