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t-Butyl 4-bromobenzoate
SpectraBase Compound ID KOh5pa7PnQ1
InChI InChI=1S/C11H13BrO2/c1-11(2,3)14-10(13)8-4-6-9(12)7-5-8/h4-7H,1-3H3
InChIKey BFJJYXUCGYOXDM-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 L7wX6hukoUA
Name t-Butyl 4-bromobenzoate
Alternate Name(s) tert-Butyl 4-bromobenzoate tert-Butyl 4-bromanylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13BrO2
InChI InChI=1S/C11H13BrO2/c1-11(2,3)14-10(13)8-4-6-9(12)7-5-8/h4-7H,1-3H3
InChIKey BFJJYXUCGYOXDM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201408516
Molecular Weight 257.127 g/mol
SMILES c1cc(C(OC(C)(C)C)=O)ccc1Br
SPLASH splash10-0zfr-4390000000-3f8626d5871416a5278e
Source of Spectrum ACI-54-2270/SM-2t
Wiley ID 1760276