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2-((4-bromophenyl)(cyclohexyl)methyl)-5-chlorothiophene
SpectraBase Compound ID 4dtgTsfBTpE
InChI InChI=1S/C17H18BrClS/c18-14-8-6-13(7-9-14)17(12-4-2-1-3-5-12)15-10-11-16(19)20-15/h6-12,17H,1-5H2
InChIKey LBAAMTHDEFCJMW-UHFFFAOYSA-N
Mol Weight 369.75 g/mol
Molecular Formula C17H18BrClS
Exact Mass 368.000112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 52d6FBoY80T
Name 2-((4-bromophenyl)(cyclohexyl)methyl)-5-chlorothiophene
Appearance Yellow oil
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Formula C17H18BrClS
InChI InChI=1S/C17H18BrClS/c18-14-8-6-13(7-9-14)17(12-4-2-1-3-5-12)15-10-11-16(19)20-15/h6-12,17H,1-5H2
InChIKey LBAAMTHDEFCJMW-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C VL MSD
Ionization Type EI
Literature Reference DOI 10.1002/anie.202016268
Molecular Weight 369.748 g/mol
SMILES c1(C(c2ccc(s2)Cl)C2CCCCC2)ccc(cc1)Br
SPLASH splash10-000i-2390000000-b2f288af5bb7442cddf7
Source of Spectrum ACI-60-SM34-4p
Wiley ID 1880282