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1,2-O-Isopropylidene-3-O-(p-phenylbenzyl)-4,5-O-[(1'S)-trans-3'-phenyl-2'-propen-1'-yl]-.beta.-D-fluctopyranose
SpectraBase Compound ID JXQa8tmT7vf
InChI InChI=1S/C31H32O6/c1-30(2)34-21-31(37-30)29(32-19-23-13-16-25(17-14-23)24-11-7-4-8-12-24)28-26(20-33-31)35-27(36-28)18-15-22-9-5-3-6-10-22/h3-18,26-29H,19-21H2,1-2H3/b18-15+/t26-,27+,28?,29-,31+/m1/s1
InChIKey ILBWBEZUFVAZBF-YQEYSYGPSA-N
Mol Weight 500.6 g/mol
Molecular Formula C31H32O6
Exact Mass 500.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYmmA794C38
Name 1,2-O-Isopropylidene-3-O-(p-phenylbenzyl)-4,5-O-[(1'S)-trans-3'-phenyl-2'-propen-1'-yl]-.beta.-D-fluctopyranose
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H32O6
InChI InChI=1S/C31H32O6/c1-30(2)34-21-31(37-30)29(32-19-23-13-16-25(17-14-23)24-11-7-4-8-12-24)28-26(20-33-31)35-27(36-28)18-15-22-9-5-3-6-10-22/h3-18,26-29H,19-21H2,1-2H3/b18-15+/t26-,27+,28?,29-,31+/m1/s1
InChIKey ILBWBEZUFVAZBF-YQEYSYGPSA-N
Molecular Weight 500.591 g/mol
SMILES [C@]12([C@@](C3O[C@@](\C=C\c4ccccc4)(O[C@@]3(CO1)[H])[H])(OCc1ccc(-c3ccccc3)cc1)[H])OC(C)(C)OC2
SPLASH splash10-014i-0900000000-67a078c124fe11d50894
Source of Spectrum J-60-574-35
Synonyms (1R,2S,4aR,6S)-5',5'-dimethyl-6-[(E)-2-phenylethenyl]-1-[(4-phenylphenyl)methoxy]-tetrahydro-1H-spiro[[1,3]dioxolo[4,5-c]pyran-2,2'-[1,4]dioxolane]
Wiley ID 1398928