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benzyl 4,6-dibenzyloxy-3-hydroxy-2-penytlbenzoate
SpectraBase Compound ID IVIWiQ6QSbl
InChI InChI=1S/C33H34O5/c1-2-3-7-20-28-31(33(35)38-24-27-18-12-6-13-19-27)29(36-22-25-14-8-4-9-15-25)21-30(32(28)34)37-23-26-16-10-5-11-17-26/h4-6,8-19,21,34H,2-3,7,20,22-24H2,1H3
InChIKey PMSHIIFUVGLYFY-UHFFFAOYSA-N
Mol Weight 510.6 g/mol
Molecular Formula C33H34O5
Exact Mass 510.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EigO2cLbYyS
Name benzyl 4,6-dibenzyloxy-3-hydroxy-2-penytlbenzoate
Alternate Name(s) benzyl 4,6-bis(benzyloxy)-3-hydroxy-2-pentylbenzoate
Comments Less than 3 mono-isotopic peaks
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Formula C33H34O5
InChI InChI=1S/C33H34O5/c1-2-3-7-20-28-31(33(35)38-24-27-18-12-6-13-19-27)29(36-22-25-14-8-4-9-15-25)21-30(32(28)34)37-23-26-16-10-5-11-17-26/h4-6,8-19,21,34H,2-3,7,20,22-24H2,1H3
InChIKey PMSHIIFUVGLYFY-UHFFFAOYSA-N
Molecular Weight 510.630 g/mol
SMILES Oc1c(c(c(cc1OCc1ccccc1)OCc1ccccc1)C(OCc1ccccc1)=O)CCCCC
SPLASH splash10-0006-9000000000-dd5532f2b7b3800e6643
Source of Spectrum B-46-301-0
Wiley ID 1400599