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rac-2-Bromo-1-methyl-4-(6-methylhept-5-en-2-yl)benzene
SpectraBase Compound ID 8b0qk5OaXuD
InChI InChI=1S/C15H21Br/c1-11(2)6-5-7-12(3)14-9-8-13(4)15(16)10-14/h6,8-10,12H,5,7H2,1-4H3/t12-/m1/s1
InChIKey XHZQPCMWDTVNNN-GFCCVEGCSA-N
Mol Weight 281.24 g/mol
Molecular Formula C15H21Br
Exact Mass 280.082664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1WfbNp9mbHs
Name rac-2-Bromo-1-methyl-4-(6-methylhept-5-en-2-yl)benzene
Appearance Colorless oil
Carrier Gas Hydrogen
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Exact Mass 280.082663676 u
Formula C15H21Br
GC Oven Program Oven temp 300 oC
InChI InChI=1S/C15H21Br/c1-11(2)6-5-7-12(3)14-9-8-13(4)15(16)10-14/h6,8-10,12H,5,7H2,1-4H3/t12-/m1/s1
InChIKey XHZQPCMWDTVNNN-GFCCVEGCSA-N
Instrument Name Agilent GC6890-HP 5973
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200058
Quality 420
SMILES C1=C(C=C(C(=C1)C)Br)[C@](C)(CCC=C(C)C)[H]
SPLASH splash10-02t9-4940000000-e83f52ff8c363d445196
Source of Spectrum K1-2022-SM12-rac-15 (DOI: 10.1002/ejoc.202200058)
Thin-Layer Chromatography 0.8 (SiO2, cHex)
Wiley ID 1898704