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4-Bromo-2-butynyl 2-cyclohexyl-2-phenylglycolate

View entire compound with spectra: 1 MS (GC)

4-Bromo-2-butynyl 2-cyclohexyl-2-phenylglycolate
SpectraBase Compound ID GR97wPIBHwA
InChI InChI=1S/C18H21BrO3/c19-13-7-8-14-22-17(20)18(21,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1,3-4,9-10,16,21H,2,5-6,11-14H2
InChIKey GITGAERLBIMKSC-UHFFFAOYSA-N
Mol Weight 365.27 g/mol
Molecular Formula C18H21BrO3
Exact Mass 364.067408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SHVaHn735k
Name 4-Bromo-2-butynyl 2-cyclohexyl-2-phenylglycolate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21BrO3
InChI InChI=1S/C18H21BrO3/c19-13-7-8-14-22-17(20)18(21,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1,3-4,9-10,16,21H,2,5-6,11-14H2
InChIKey GITGAERLBIMKSC-UHFFFAOYSA-N
Molecular Weight 365.267 g/mol
SMILES OC(C(=O)OCC#CCBr)(c1ccccc1)C1CCCCC1
SPLASH splash10-0a4r-2900000000-9486219bc9ea74e12233
Source of Spectrum KO-8-508-0
Synonyms 4-Bromo-2-butynyl cyclohexyl(hydroxy)phenylacetate
Wiley ID 1350656