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ethyl 4-benzyloxy-6-[(2'-heptyl-1',3'-dioxolan-2'-yl)methyl]-2-hydroxybenzoate
SpectraBase Compound ID GOeuagzFFFX
InChI InChI=1S/C27H36O6/c1-3-5-6-7-11-14-27(32-15-16-33-27)19-22-17-23(31-20-21-12-9-8-10-13-21)18-24(28)25(22)26(29)30-4-2/h8-10,12-13,17-18,28H,3-7,11,14-16,19-20H2,1-2H3
InChIKey URAMRBVWZQUVID-UHFFFAOYSA-N
Mol Weight 456.6 g/mol
Molecular Formula C27H36O6
Exact Mass 456.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8D1Avj0KNMz
Name ethyl 4-benzyloxy-6-[(2'-heptyl-1',3'-dioxolan-2'-yl)methyl]-2-hydroxybenzoate
Comments Less than 3 mono-isotopic peaks
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Formula C27H36O6
InChI InChI=1S/C27H36O6/c1-3-5-6-7-11-14-27(32-15-16-33-27)19-22-17-23(31-20-21-12-9-8-10-13-21)18-24(28)25(22)26(29)30-4-2/h8-10,12-13,17-18,28H,3-7,11,14-16,19-20H2,1-2H3
InChIKey URAMRBVWZQUVID-UHFFFAOYSA-N
Molecular Weight 456.579 g/mol
SMILES Oc1c(c(CC2(OCCO2)CCCCCCC)cc(c1)OCc1ccccc1)C(=O)OCC
SPLASH splash10-00di-0900000000-6905a8c883a17f4ff0c9
Source of Spectrum JA-49-917-0
Synonyms ethyl 4-(benzyloxy)-2-[(2-heptyl-1,3-dioxolan-2-yl)methyl]-6-hydroxybenzoate
Wiley ID 1389369