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1,2-o-Isopropylidene-3-o-(m-methylbenzyl)-.beta.-D-fructopyranose
SpectraBase Compound ID GrLoiaBRFy3
InChI InChI=1S/C17H24O6/c1-11-5-4-6-12(7-11)8-20-15-14(19)13(18)9-21-17(15)10-22-16(2,3)23-17/h4-7,13-15,18-19H,8-10H2,1-3H3/t13-,14-,15+,17+/m1/s1
InChIKey NFMLGOHZQMKVRN-AIANPOQGSA-N
Mol Weight 324.37 g/mol
Molecular Formula C17H24O6
Exact Mass 324.157288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 39UhOtYgN2X
Name 1,2-o-Isopropylidene-3-o-(m-methylbenzyl)-.beta.-D-fructopyranose
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.157288487 u
Formula C17H24O6
InChI InChI=1S/C17H24O6/c1-11-5-4-6-12(7-11)8-20-15-14(19)13(18)9-21-17(15)10-22-16(2,3)23-17/h4-7,13-15,18-19H,8-10H2,1-3H3/t13-,14-,15+,17+/m1/s1
InChIKey NFMLGOHZQMKVRN-AIANPOQGSA-N
Molecular Weight 324.373 g/mol
SMILES [C@@]12([C@]([C@](O)([C@@](CO2)(O)[H])[H])(OCC=2C=C(C)C=CC2)[H])OC(C)(C)OC1