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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 HEMYwZ3M6dK
Name 3-Methyl-1,1'-biphenyl
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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 Agilent 6890N-WatersMicromass Quatro Micro spectrometer
Ionization Type EI
Literature Reference DOI 10.1002/anie.202002595
Molecular Weight 168.239 g/mol
SMILES c1cc(ccc1)-c1cc(ccc1)C
SPLASH splash10-014i-0900000000-38b2140d36109b10051a
Source of Spectrum ACI-59-SM20-5e
Wiley ID 1858257