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1-(Bromomethyl)-3,4-dipentylbenzene
SpectraBase Compound ID Zcrjp8xIdW
InChI InChI=1S/C17H27Br/c1-3-5-7-9-16-12-11-15(14-18)13-17(16)10-8-6-4-2/h11-13H,3-10,14H2,1-2H3
InChIKey OQMQEIVTPNFPET-UHFFFAOYSA-N
Mol Weight 311.31 g/mol
Molecular Formula C17H27Br
Exact Mass 310.129614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2fean6IyFnb
Name 1-(Bromomethyl)-3,4-dipentylbenzene
Alternate Name(s) 4-(bromomethyl)-1,2-dipentylbenzene
Comments Less than 3 mono-isotopic peaks
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Formula C17H27Br
InChI InChI=1S/C17H27Br/c1-3-5-7-9-16-12-11-15(14-18)13-17(16)10-8-6-4-2/h11-13H,3-10,14H2,1-2H3
InChIKey OQMQEIVTPNFPET-UHFFFAOYSA-N
Molecular Weight 311.307 g/mol
SMILES c1(c(ccc(c1)CBr)CCCCC)CCCCC
SPLASH splash10-001i-0091000000-3434ab55feef3ad6f8f5
Source of Spectrum D1-1998-312-4
Wiley ID 835118