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icosyl 4-methoxybenzoate
SpectraBase Compound ID G9wG0uY5neP
InChI InChI=1S/C28H48O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-31-28(29)26-21-23-27(30-2)24-22-26/h21-24H,3-20,25H2,1-2H3
InChIKey SXLHWJSGHRIOQQ-UHFFFAOYSA-N
Mol Weight 432.7 g/mol
Molecular Formula C28H48O3
Exact Mass 432.360345 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQeh2POPDKV
Name icosyl 4-methoxybenzoate
CAS Registry Number 56954-79-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H48O3
InChI InChI=1S/C28H48O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-31-28(29)26-21-23-27(30-2)24-22-26/h21-24H,3-20,25H2,1-2H3
InChIKey SXLHWJSGHRIOQQ-UHFFFAOYSA-N
Molecular Weight 432.689 g/mol
SMILES C(c1ccc(cc1)OC)(=O)OCCCCCCCCCCCCCCCCCCCC
SPLASH splash10-0udi-0900000000-b04f0a1e62bcc0bf97a7
Source of Spectrum W5-34952-30584-30584
Synonyms 4-Methoxybenzoic acid eicosyl ester
Wiley ID 1382505