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trans-2-(3,4,5-Trimethoxybenzyl)-3-(.alpha.-hydroxy-3-methoxy-4-isopropyloxybenzyl)butanolide
SpectraBase Compound ID FnM6HgGLYVK
InChI InChI=1S/C25H32O8/c1-14(2)33-19-8-7-16(12-20(19)28-3)23(26)18-13-32-25(27)17(18)9-15-10-21(29-4)24(31-6)22(11-15)30-5/h7-8,10-12,14,17-18,23,26H,9,13H2,1-6H3/t17-,18+,23?/m1/s1
InChIKey CKLTZYRJOWXMLS-BATLZEKGSA-N
Mol Weight 460.5 g/mol
Molecular Formula C25H32O8
Exact Mass 460.209718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Al5rPwpcIXV
Name trans-2-(3,4,5-Trimethoxybenzyl)-3-(.alpha.-hydroxy-3-methoxy-4-isopropyloxybenzyl)butanolide
Alternate Name(s) (3R,4R)-4-[hydroxy(4-isopropoxy-3-methoxyphenyl)methyl]-3-(3,4,5-trimethoxybenzyl)dihydro-2(3H)-furanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H32O8
InChI InChI=1S/C25H32O8/c1-14(2)33-19-8-7-16(12-20(19)28-3)23(26)18-13-32-25(27)17(18)9-15-10-21(29-4)24(31-6)22(11-15)30-5/h7-8,10-12,14,17-18,23,26H,9,13H2,1-6H3/t17-,18+,23?/m1/s1
InChIKey CKLTZYRJOWXMLS-BATLZEKGSA-N
Molecular Weight 460.523 g/mol
SMILES OC([C@@]1([C@](C(=O)OC1)(Cc1cc(OC)c(c(c1)OC)OC)[H])[H])c1cc(OC)c(cc1)OC(C)C
SPLASH splash10-0gx0-0900300000-879f92377984bd505401
Source of Spectrum H1-43-2453-21
Wiley ID 758148