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1,2:5,6-Di-O isopropylidene-.alpha.,D-allofuranose3-O-(R)-2-(Naphthalen-2-yl)1-phenylethanesulfonate
SpectraBase Compound ID AEyclTHoH85
InChI InChI=1S/C30H34O8S/c1-29(2)33-18-23(35-29)25-26(27-28(34-25)37-30(3,4)36-27)38-39(31,32)24(21-11-6-5-7-12-21)17-19-14-15-20-10-8-9-13-22(20)16-19/h5-16,23-28H,17-18H2,1-4H3/t23-,24-,25-,26-,27-,28-/m1/s1
InChIKey ZRXJDBUBNHFLFA-BXZOIBFVSA-N
Mol Weight 554.7 g/mol
Molecular Formula C30H34O8S
Exact Mass 554.197439 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F1wm51bDgZJ
Name 1,2:5,6-Di-O isopropylidene-.alpha.,D-allofuranose3-O-(R)-2-(Naphthalen-2-yl)1-phenylethanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H34O8S
InChI InChI=1S/C30H34O8S/c1-29(2)33-18-23(35-29)25-26(27-28(34-25)37-30(3,4)36-27)38-39(31,32)24(21-11-6-5-7-12-21)17-19-14-15-20-10-8-9-13-22(20)16-19/h5-16,23-28H,17-18H2,1-4H3/t23-,24-,25-,26-,27-,28-/m1/s1
InChIKey ZRXJDBUBNHFLFA-BXZOIBFVSA-N
Molecular Weight 554.654 g/mol
SMILES [C@@]1(OS([C@](Cc2cc3ccccc3cc2)(c2ccccc2)[H])(=O)=O)([C@@]2([C@@](OC(O2)(C)C)(O[C@@]1([C@@]1(OC(C)(C)OC1)[H])[H])[H])[H])[H]
SPLASH splash10-0f89-0791040000-f516390e2e45e8265878
Source of Spectrum KC-61-3240-20
Synonyms (3aR,5R,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-tetrahydro-2H-furo[2,3-d][1,3]dioxol-6-yl (1R)-2-(naphthalen-2-yl)-1-phenylethane-1-sulfonate 1,2:5,6-Di-O isopropylidene-.alpha.,D-allofuranose (R)-2-(Naphthalen-2-yl)1-phenylethanesulfonate
Wiley ID 1628334