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(2E)-(1,2:5,6-Di-O-isopropylidene-.alpha.,D-glucofuranose-3-O-yl)-4-ethyl 2-fluorohex-2-enoate
SpectraBase Compound ID J7vEFwVf2OH
InChI InChI=1S/C20H31FO7/c1-7-11(8-2)9-12(21)17(22)24-15-14(13-10-23-19(3,4)26-13)25-18-16(15)27-20(5,6)28-18/h9,11,13-16,18H,7-8,10H2,1-6H3/b12-9+/t13-,14-,15+,16-,18-/m1/s1
InChIKey RPEGNHBPVMFPFX-FEROJFLTSA-N
Mol Weight 402.46 g/mol
Molecular Formula C20H31FO7
Exact Mass 402.205381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58g5rQiqUC
Name (2E)-(1,2:5,6-Di-O-isopropylidene-.alpha.,D-glucofuranose-3-O-yl)-4-ethyl 2-fluorohex-2-enoate
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Formula C20H31FO7
InChI InChI=1S/C20H31FO7/c1-7-11(8-2)9-12(21)17(22)24-15-14(13-10-23-19(3,4)26-13)25-18-16(15)27-20(5,6)28-18/h9,11,13-16,18H,7-8,10H2,1-6H3/b12-9+/t13-,14-,15+,16-,18-/m1/s1
InChIKey RPEGNHBPVMFPFX-FEROJFLTSA-N
Molecular Weight 402.459 g/mol
SMILES [C@]12([C@]([C@@]([C@@]3(OC(C)(C)OC3)[H])(O[C@@]1(OC(O2)(C)C)[H])[H])(OC(\C(=C/C(CC)CC)F)=O)[H])[H]
SPLASH splash10-0f79-0915000000-8db971c1ef58dd16cf24
Source of Spectrum SO-0-434-7
Wiley ID 865307