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Benzoic acid, 2-methoxy-6-methyl-3,4-bis(phenylmethoxy)-, ethyl ester
SpectraBase Compound ID kBo5N7hkFJ
InChI InChI=1S/C25H26O5/c1-4-28-25(26)22-18(2)15-21(29-16-19-11-7-5-8-12-19)23(24(22)27-3)30-17-20-13-9-6-10-14-20/h5-15H,4,16-17H2,1-3H3
InChIKey QJGSDWHEXGXDHV-UHFFFAOYSA-N
Mol Weight 406.48 g/mol
Molecular Formula C25H26O5
Exact Mass 406.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1VIn1ghBQhz
Name Benzoic acid, 2-methoxy-6-methyl-3,4-bis(phenylmethoxy)-, ethyl ester
Alternate Name(s) ethyl 3,4-bis(benzyloxy)-2-methoxy-6-methylbenzoate ethyl 3,4-dibenzyloxy-2-methoxy-6-methylbenzoate Ethyl 3-methoxy-2,4-dibenzyloxy-6-methylbenzoate methyl 2,4-dibenzyloxy-5-methoxy-3,6-dimethylbenzoate
CAS Registry Number 124281-17-0
Comments Less than 3 mono-isotopic peaks
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Formula C25H26O5
InChI InChI=1S/C25H26O5/c1-4-28-25(26)22-18(2)15-21(29-16-19-11-7-5-8-12-19)23(24(22)27-3)30-17-20-13-9-6-10-14-20/h5-15H,4,16-17H2,1-3H3
InChIKey QJGSDWHEXGXDHV-UHFFFAOYSA-N
Molecular Weight 406.478 g/mol
SMILES c1(c(c(OCc2ccccc2)c(cc1C)OCc1ccccc1)OC)C(=O)OCC
SPLASH splash10-0006-9000000000-f9f08eaf15a204ba5276
Source of Spectrum B-48-635-0
Wiley ID 1372314