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Ethyl 4-(2-bromoethyl)-6-butyl-1-hydroxy-3,5-dimethyl-2-benzoate
SpectraBase Compound ID F9TOZNzKI3a
InChI InChI=1S/C17H25BrO3/c1-5-7-8-14-11(3)13(9-10-18)12(4)15(16(14)19)17(20)21-6-2/h19H,5-10H2,1-4H3
InChIKey CETUKFZSWCQUKL-UHFFFAOYSA-N
Mol Weight 357.29 g/mol
Molecular Formula C17H25BrO3
Exact Mass 356.098708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57BG0bsfXZc
Name Ethyl 4-(2-bromoethyl)-6-butyl-1-hydroxy-3,5-dimethyl-2-benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25BrO3
InChI InChI=1S/C17H25BrO3/c1-5-7-8-14-11(3)13(9-10-18)12(4)15(16(14)19)17(20)21-6-2/h19H,5-10H2,1-4H3
InChIKey CETUKFZSWCQUKL-UHFFFAOYSA-N
Molecular Weight 357.288 g/mol
SMILES Oc1c(c(c(c(C)c1CCCC)CCBr)C)C(=O)OCC
SPLASH splash10-0203-9143000000-0006550db54670ef1b36
Source of Spectrum F-69-9133-3
Synonyms 5-(2-bromoethyl)-3-butyl-2-hydroxy-4,6-dimethylbenzoic acid ethyl ester Ethyl 5-(2-bromoethyl)-3-butyl-2-hydroxy-4,6-dimethylbenzoate Ethyl 5-(2-bromoethyl)-3-butyl-2-hydroxy-4,6-dimethyl-benzoate Ethyl 3-(2-bromoethyl)-5-butyl-2,4-dimethyl-6-oxidanyl-benzoate
Wiley ID 1595959