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2',4',6'-Trimethylbiphenyl-2-carbonitrile
SpectraBase Compound ID 90aj7pBFScB
InChI InChI=1S/C16H15N/c1-11-8-12(2)16(13(3)9-11)15-7-5-4-6-14(15)10-17/h4-9H,1-3H3
InChIKey CWTAXZYCGGVNKT-UHFFFAOYSA-N
Mol Weight 221.3 g/mol
Molecular Formula C16H15N
Exact Mass 221.120449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IrCTRV7GtHx
Name 2',4',6'-Trimethylbiphenyl-2-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15N
InChI InChI=1S/C16H15N/c1-11-8-12(2)16(13(3)9-11)15-7-5-4-6-14(15)10-17/h4-9H,1-3H3
InChIKey CWTAXZYCGGVNKT-UHFFFAOYSA-N
Molecular Weight 221.303 g/mol
SMILES c1(c(cc(cc1C)C)C)-c1c(C#N)cccc1
SPLASH splash10-0afu-0890000000-003681c88c7fb0cba670
Source of Spectrum KC-61-11173-10
Synonyms 2',4',6'-trimethyl[1,1'-biphenyl]-2-carbonitrile 2-(2,4,6-Trimethylphenyl)benzonitrile 2-(2,4,6-Trimethylphenyl)benzenecarbonitrile
Wiley ID 1631263