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4'-bromo-3'-methyl-1,2,3,4-tetrahydro-1,1'-biphenyl
SpectraBase Compound ID 9NW2DyewuI1
InChI InChI=1S/C13H15Br/c1-10-9-12(7-8-13(10)14)11-5-3-2-4-6-11/h3,5,7-9,11H,2,4,6H2,1H3
InChIKey FJHWUJUBPWDMBB-UHFFFAOYSA-N
Mol Weight 251.17 g/mol
Molecular Formula C13H15Br
Exact Mass 250.035713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BwvDeNXZnx1
Name 4'-bromo-3'-methyl-1,2,3,4-tetrahydro-1,1'-biphenyl
Appearance Colorless oil
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Formula C13H15Br
InChI InChI=1S/C13H15Br/c1-10-9-12(7-8-13(10)14)11-5-3-2-4-6-11/h3,5,7-9,11H,2,4,6H2,1H3
InChIKey FJHWUJUBPWDMBB-UHFFFAOYSA-N
Instrument Name Finnigan Mat 95Q
Ionization Type EI
Literature Reference DOI 10.1002/anie.202012496
Molecular Weight 251.167 g/mol
Reported Formula C13H15Br
SMILES c1(cc(ccc1Br)C1C=CCCC1)C
SPLASH splash10-0f96-0910000000-3a75eecf4fe812125c39
Source of Spectrum ACI-60-SM31-9d
Thin-Layer Chromatography Rf = 0.71 (isohexane)
Wiley ID 1880471