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Ethyl 4,6-dibenzyloxy-3-chloro-2-pentylbenzoate
SpectraBase Compound ID 1BIJB3IiZZ2
InChI InChI=1S/C28H31ClO4/c1-3-5-8-17-23-26(28(30)31-4-2)24(32-19-21-13-9-6-10-14-21)18-25(27(23)29)33-20-22-15-11-7-12-16-22/h6-7,9-16,18H,3-5,8,17,19-20H2,1-2H3
InChIKey XHHBGDAOGWWIJN-UHFFFAOYSA-N
Mol Weight 467.01 g/mol
Molecular Formula C28H31ClO4
Exact Mass 466.191087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IjpRMAma7SS
Name Ethyl 4,6-dibenzyloxy-3-chloro-2-pentylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H31ClO4
InChI InChI=1S/C28H31ClO4/c1-3-5-8-17-23-26(28(30)31-4-2)24(32-19-21-13-9-6-10-14-21)18-25(27(23)29)33-20-22-15-11-7-12-16-22/h6-7,9-16,18H,3-5,8,17,19-20H2,1-2H3
InChIKey XHHBGDAOGWWIJN-UHFFFAOYSA-N
Molecular Weight 467.005 g/mol
SMILES c1(c(c(Cl)c(cc1OCc1ccccc1)OCc1ccccc1)CCCCC)C(=O)OCC
SPLASH splash10-0006-0090000000-201616a18a88ff74b680
Source of Spectrum JA-50-971-0
Synonyms Ethyl 4,6-bis(benzyloxy)-3-chloro-2-pentylbenzoate
Wiley ID 1392010