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Benzyl ( 4-O-benzyl-2-O-methyl)lecanorate
SpectraBase Compound ID 1OuYIDdp0yX
InChI InChI=1S/C31H28O7/c1-20-15-25(16-26(32)28(20)30(33)37-19-23-12-8-5-9-13-23)38-31(34)29-21(2)14-24(17-27(29)35-3)36-18-22-10-6-4-7-11-22/h4-17,32H,18-19H2,1-3H3
InChIKey YXOBLDSDOQRCDV-UHFFFAOYSA-N
Mol Weight 512.56 g/mol
Molecular Formula C31H28O7
Exact Mass 512.183503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4d9aldJq4D
Name Benzyl ( 4-O-benzyl-2-O-methyl)lecanorate
Comments Less than 3 mono-isotopic peaks
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Formula C31H28O7
InChI InChI=1S/C31H28O7/c1-20-15-25(16-26(32)28(20)30(33)37-19-23-12-8-5-9-13-23)38-31(34)29-21(2)14-24(17-27(29)35-3)36-18-22-10-6-4-7-11-22/h4-17,32H,18-19H2,1-3H3
InChIKey YXOBLDSDOQRCDV-UHFFFAOYSA-N
Molecular Weight 512.558 g/mol
SMILES Oc1cc(OC(c2c(cc(cc2C)OCc2ccccc2)OC)=O)cc(c1C(OCc1ccccc1)=O)C
SPLASH splash10-0006-9000000000-1fb979885e914c430286
Source of Spectrum B-51-1049-34
Synonyms 4-[(benzyloxy)carbonyl]-3-hydroxy-5-methylphenyl 4-(benzyloxy)-2-methoxy-6-methylbenzoate
Wiley ID 745865