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Ethyl 2-(3-bromonaphthalen-2-yl)-2-methylpropanoate
SpectraBase Compound ID 4ObBj0u0Ide
InChI InChI=1S/C16H17BrO2/c1-4-19-15(18)16(2,3)13-9-11-7-5-6-8-12(11)10-14(13)17/h5-10H,4H2,1-3H3
InChIKey RCKPTACVRWWGHR-UHFFFAOYSA-N
Mol Weight 321.21 g/mol
Molecular Formula C16H17BrO2
Exact Mass 320.041193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZDMmgpwPAW
Name Ethyl 2-(3-bromonaphthalen-2-yl)-2-methylpropanoate
Appearance Colorless oil
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Formula C16H17BrO2
InChI InChI=1S/C16H17BrO2/c1-4-19-15(18)16(2,3)13-9-11-7-5-6-8-12(11)10-14(13)17/h5-10H,4H2,1-3H3
InChIKey RCKPTACVRWWGHR-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C VL/5975 GC
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c00617
Molecular Weight 321.214 g/mol
Reported Formula C16H17BrO2
SMILES c12cc(c(cc2cccc1)Br)C(C)(C(=O)OCC)C
SPLASH splash10-03dl-0290000000-5bc0cf8a64e842ffd3e8
Source of Spectrum A1-23-SM10-1n
Thin-Layer Chromatography Rf = 0.35 (silica, petroleum ether/ethyl acetate, 20:1)
Wiley ID 1868160