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3-Bromo-2, 4, 6-trimethylphenyl acetate
SpectraBase Compound ID FBvH7Pxi2Gz
InChI InChI=1S/C11H13BrO2/c1-6-5-7(2)11(14-9(4)13)8(3)10(6)12/h5H,1-4H3
InChIKey LDDGZOFIXIAMEI-UHFFFAOYSA-N
Mol Weight 257.13 g/mol
Molecular Formula C11H13BrO2
Exact Mass 256.009893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A2e2lsbJMl3
Name 3-Bromo-2, 4, 6-trimethylphenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13BrO2
InChI InChI=1S/C11H13BrO2/c1-6-5-7(2)11(14-9(4)13)8(3)10(6)12/h5H,1-4H3
InChIKey LDDGZOFIXIAMEI-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol202075x
Molecular Weight 257.127 g/mol
SMILES c1(C)cc(c(OC(C)=O)c(c1Br)C)C
SPLASH splash10-03y0-2490000000-3aa0249e3ed312d49e90
Source of Spectrum A1-13-4988/SMS5-2d
Synonyms 3-Bromo-2,4,6-trimethylphenyl acetate Acetic acid (3-bromo-2,4,6-trimethylphenyl) ester (3-bromo-2,4,6-trimethylphenyl) acetate (3-bromo-2,4,6-trimethyl-phenyl) acetate (3-bromanyl-2,4,6-trimethyl-phenyl) ethanoate
Wiley ID 1753777