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Benzenepropanoic acid, .alpha.-(1,1-dimethylethyl)-2,4,6-trimethyl-, ethyl ester
SpectraBase Compound ID 4pT6KNnMUMI
InChI InChI=1S/C18H28O2/c1-8-20-17(19)16(18(5,6)7)11-15-13(3)9-12(2)10-14(15)4/h9-10,16H,8,11H2,1-7H3
InChIKey RZIZNRUUYPRZLG-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 Bq9IBBIdaGm
Name Benzenepropanoic acid, .alpha.-(1,1-dimethylethyl)-2,4,6-trimethyl-, ethyl ester
CAS Registry Number 80152-87-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O2
InChI InChI=1S/C18H28O2/c1-8-20-17(19)16(18(5,6)7)11-15-13(3)9-12(2)10-14(15)4/h9-10,16H,8,11H2,1-7H3
InChIKey RZIZNRUUYPRZLG-UHFFFAOYSA-N
Molecular Weight 276.420 g/mol
SMILES c1(CC(C(=O)OCC)C(C)(C)C)c(cc(cc1C)C)C
SPLASH splash10-004i-0900000000-260f8b12ebfc5725a643
Source of Spectrum SB-35-427-0
Synonyms Ethyl 2-(mesitylmethyl)-3,3-dimethylbutanoate Ethyl 4,4-dimethyl-3-(2,4,6-trimethylphenyl)pentanoate
Wiley ID 1280481