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3-Methylbiphenyl
SpectraBase Compound ID GBsM3TVygTH
InChI InChI=1S/C13H12/c1-11-6-5-9-13(10-11)12-7-3-2-4-8-12/h2-10H,1H3
InChIKey NPDIDUXTRAITDE-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 8CM5T7EpjE1
Name 3-Methyl-1,1'-biphenyl
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 168.093900386 u
Formula C13H12
InChI InChI=1S/C13H12/c1-11-6-5-9-13(10-11)12-7-3-2-4-8-12/h2-10H,1H3
InChIKey NPDIDUXTRAITDE-UHFFFAOYSA-N
Instrument Name HP 5989B
Ionization Type EI
Literature Reference DOI 10.1002/chem.201600420
Molecular Weight 168.239 g/mol
Quality 224
SMILES C1=CC=C(C=C1C)C1=CC=CC=C1
SPLASH splash10-014i-0900000000-ba611a6ab86edce6d43a
Source of Spectrum QE-22-SM19-19-1 (DOI: 10.1002/chem.201600420)
Thin-Layer Chromatography 0.50 (Hexane)
Wiley ID 1903212