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Methyl 4-bromo-2,2-dimethyl-3-phenylbutanoate
SpectraBase Compound ID GUlK73rB1yh
InChI InChI=1S/C13H17BrO2/c1-13(2,12(15)16-3)11(9-14)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3
InChIKey YCNKBPJWARUONK-UHFFFAOYSA-N
Mol Weight 285.18 g/mol
Molecular Formula C13H17BrO2
Exact Mass 284.041193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7tYSKPpa0U1
Name Methyl 4-bromo-2,2-dimethyl-3-phenylbutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17BrO2
InChI InChI=1S/C13H17BrO2/c1-13(2,12(15)16-3)11(9-14)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3
InChIKey YCNKBPJWARUONK-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol1012108
Molecular Weight 285.181 g/mol
SMILES C(C)(C(c1ccccc1)CBr)(C(OC)=O)C
SPLASH splash10-0uei-0900000000-3cc53187e5e08e61aa72
Source of Spectrum A1-12-3390/SMS20-5a
Wiley ID 1752412