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1-Bromo-4-n-hexylbenzene

View entire compound with spectra: 2 FTIR, 1 Raman, and 2 MS (GC)

1-Bromo-4-n-hexylbenzene
SpectraBase Compound ID Gpjtg1b7RuL
InChI InChI=1S/C12H17Br/c1-2-3-4-5-6-11-7-9-12(13)10-8-11/h7-10H,2-6H2,1H3
InChIKey MXHOLIARBWJKCR-UHFFFAOYSA-N
Mol Weight 241.17 g/mol
Molecular Formula C12H17Br
Exact Mass 240.051364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3tzToINWyG
Name 1-Bromo-4-hexylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.051363547 u
Formula C12H17Br
InChI InChI=1S/C12H17Br/c1-2-3-4-5-6-11-7-9-12(13)10-8-11/h7-10H,2-6H2,1H3
InChIKey MXHOLIARBWJKCR-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0004.804
Molecular Weight 241.172 g/mol
Quality 216
Reported Formula C12H17Br
SMILES C1(Br)=CC=C(C=C1)CCCCCC
SPLASH splash10-00r6-3940000000-c3cc159fc173d8e42081
Source of Spectrum ARK-2003-29-29-2 (DOI: 10.3998/ark.5550190.0004.804)
Wiley ID 1900028