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Isobutyl (R)-2,4-Dibenzyloxy-6-(6-hydroxyheptyl)benzoate
SpectraBase Compound ID 3kh5EXlgIrI
InChI InChI=1S/C32H40O5/c1-24(2)21-37-32(34)31-28(18-12-4-7-13-25(3)33)19-29(35-22-26-14-8-5-9-15-26)20-30(31)36-23-27-16-10-6-11-17-27/h5-6,8-11,14-17,19-20,24-25,33H,4,7,12-13,18,21-23H2,1-3H3/t25-/m1/s1
InChIKey MZEVKIPHMFINCP-RUZDIDTESA-N
Mol Weight 504.7 g/mol
Molecular Formula C32H40O5
Exact Mass 504.287574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DHJp5eSQUpZ
Name Isobutyl (R)-2,4-Dibenzyloxy-6-(6-hydroxyheptyl)benzoate
Alternate Name(s) isobutyl 2,4-bis(benzyloxy)-6-[(6R)-6-hydroxyheptyl]benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H40O5
InChI InChI=1S/C32H40O5/c1-24(2)21-37-32(34)31-28(18-12-4-7-13-25(3)33)19-29(35-22-26-14-8-5-9-15-26)20-30(31)36-23-27-16-10-6-11-17-27/h5-6,8-11,14-17,19-20,24-25,33H,4,7,12-13,18,21-23H2,1-3H3/t25-/m1/s1
InChIKey MZEVKIPHMFINCP-RUZDIDTESA-N
Molecular Weight 504.667 g/mol
SMILES O[C@@](CCCCCc1c(c(cc(c1)OCc1ccccc1)OCc1ccccc1)C(OCC(C)C)=O)(C)[H]
SPLASH splash10-0006-9102000000-6c4e36189fd6c655a8dd
Source of Spectrum KC-57-5383-23
Wiley ID 1624640