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(3S,4R)-4-(3,4-Dimethoxy-benzyloxy)-3-hydroxy-6-methyl-hept-6-enoic acid tert-butyl ester
SpectraBase Compound ID JSMarz3oPa6
InChI InChI=1S/C21H32O6/c1-14(2)10-18(16(22)12-20(23)27-21(3,4)5)26-13-15-8-9-17(24-6)19(11-15)25-7/h8-9,11,16,18,22H,1,10,12-13H2,2-7H3/t16-,18+/m0/s1
InChIKey IJPJQYHREYJOFX-FUHWJXTLSA-N
Mol Weight 380.5 g/mol
Molecular Formula C21H32O6
Exact Mass 380.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lbrr6dxztxI
Name (3S,4R)-4-(3,4-Dimethoxy-benzyloxy)-3-hydroxy-6-methyl-hept-6-enoic acid tert-butyl ester
Alternate Name(s) t-Butyl 4-[(3',4'-dimethoxybenzyl)oxy]-6-methyl-3-oxo-6-heptenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O6
InChI InChI=1S/C21H32O6/c1-14(2)10-18(16(22)12-20(23)27-21(3,4)5)26-13-15-8-9-17(24-6)19(11-15)25-7/h8-9,11,16,18,22H,1,10,12-13H2,2-7H3/t16-,18+/m0/s1
InChIKey IJPJQYHREYJOFX-FUHWJXTLSA-N
Molecular Weight 380.481 g/mol
SMILES O[C@@](CC(OC(C)(C)C)=O)([C@](OCc1cc(OC)c(cc1)OC)(CC(=C)C)[H])[H]
SPLASH splash10-0udi-0900000000-47551e69a50225a0aef9
Source of Spectrum QE-15-4036-anti-15
Wiley ID 1692818