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Benzenepropanoic acid, .beta.-(1,1-dimethylethyl)-2,4,6-trimethyl-, ethyl ester
SpectraBase Compound ID 8djIX9fuUxP
InChI InChI=1S/C18H28O2/c1-8-20-16(19)11-15(18(5,6)7)17-13(3)9-12(2)10-14(17)4/h9-10,15H,8,11H2,1-7H3
InChIKey CIULTBTXFZAEDD-UHFFFAOYSA-N
Mol Weight 276.42 g/mol
Molecular Formula C18H28O2
Exact Mass 276.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5v1RDSiY7YT
Name Benzenepropanoic acid, .beta.-(1,1-dimethylethyl)-2,4,6-trimethyl-, ethyl ester
CAS Registry Number 80152-86-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O2
InChI InChI=1S/C18H28O2/c1-8-20-16(19)11-15(18(5,6)7)17-13(3)9-12(2)10-14(17)4/h9-10,15H,8,11H2,1-7H3
InChIKey CIULTBTXFZAEDD-UHFFFAOYSA-N
Molecular Weight 276.420 g/mol
SMILES c1(C(C(C)(C)C)CC(=O)OCC)c(cc(cc1C)C)C
SPLASH splash10-001i-0940000000-6af5f029b116435c70b6
Source of Spectrum SB-35-427-0
Synonyms Ethyl 3,3-dimethyl-2-(2,4,6-trimethylphenyl)butanoate Ethyl 3-mesityl-4,4-dimethylpentanoate
Wiley ID 1280482