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4-Methylbiphenyl
SpectraBase Compound ID 1dCYAGNc7wD
InChI InChI=1S/C13H12/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12/h2-10H,1H3
InChIKey ZZLCFHIKESPLTH-UHFFFAOYSA-N
Mol Weight 168.24 g/mol
Molecular Formula C13H12
Exact Mass 168.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWVcvObE4Ja
Name 4-Methylbiphenyl
CAS Registry Number 644-08-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C13H12/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12/h2-10H,1H3
InChIKey ZZLCFHIKESPLTH-UHFFFAOYSA-N
Molecular Weight 168.239 g/mol
SMILES c1cc(ccc1C)-c1ccccc1
SPLASH splash10-014i-2900000000-04fd0ebab1d062869d17
Source ex ALDRICH
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Methyl biphenyl<4->
Wiley ID 1886693