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(1,2:5,6-Di-O-Isopropyliden-.alpha.,D-glucofuranose-3-O-yl) 4-ethyl, 2-methyl 3-hexenoate
SpectraBase Compound ID Jq2op1vmTwg
InChI InChI=1S/C21H34O7/c1-8-13(9-2)10-12(3)18(22)24-16-15(14-11-23-20(4,5)26-14)25-19-17(16)27-21(6,7)28-19/h10,12,14-17,19H,8-9,11H2,1-7H3/t12?,14-,15-,16+,17-,19-/m1/s1
InChIKey CEGATSOLITZDAF-JZSNTMGKSA-N
Mol Weight 398.5 g/mol
Molecular Formula C21H34O7
Exact Mass 398.230453 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1RGChjOoXgm
Name (1,2:5,6-Di-O-Isopropyliden-.alpha.,D-glucofuranose-3-O-yl) 4-ethyl, 2-methyl 3-hexenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O7
InChI InChI=1S/C21H34O7/c1-8-13(9-2)10-12(3)18(22)24-16-15(14-11-23-20(4,5)26-14)25-19-17(16)27-21(6,7)28-19/h10,12,14-17,19H,8-9,11H2,1-7H3/t12?,14-,15-,16+,17-,19-/m1/s1
InChIKey CEGATSOLITZDAF-JZSNTMGKSA-N
Molecular Weight 398.496 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)C)=O)[H])[H]
SPLASH splash10-0udr-0900000000-4ca2e5393b38955973a7
Source of Spectrum QC-3-765-2
Wiley ID 883066