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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 JfsndZlMlIm
Name 1-methyl-3-phenyl-benzene
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 Agilent technologies 7000 C GC/MS Triple Quad-7890B
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200497
Molecular Weight 168.239 g/mol
Quality 27
SMILES C1=CC=CC(=C1)C1=CC(=CC=C1)C
SPLASH splash10-014i-0900000000-b771d2da1e97158e81e3
Source of Spectrum K1-2022-SM7-7-1 (DOI: 10.1002/ejoc.202200497)
Wiley ID 1898825