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6-Bromohexyl benzoate
SpectraBase Compound ID EqvDfnVhtpj
InChI InChI=1S/C13H17BrO2/c1-2-3-9-12(14)10-16-13(15)11-7-5-4-6-8-11/h4-8,12H,2-3,9-10H2,1H3
InChIKey BITZVAJQHMZQED-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 B8rCoHyGUTQ
Name 6-Bromohexyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17BrO2
InChI InChI=1S/C13H17BrO2/c1-2-3-9-12(14)10-16-13(15)11-7-5-4-6-8-11/h4-8,12H,2-3,9-10H2,1H3
InChIKey BITZVAJQHMZQED-UHFFFAOYSA-N
Molecular Weight 285.181 g/mol
SMILES C(OCC(Br)CCCC)(=O)c1ccccc1
SPLASH splash10-0a4i-1900000000-dcf5a25350ebc620c15a
Source of Spectrum F9-1994-1338-3
Synonyms 2-Bromohexyl benzoate [2'-Bromo-2'-butylethyl]benzoate
Wiley ID 1566934