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4'-Phenoxy-[1,1'-biphenyl]-4-carbonitrile
SpectraBase Compound ID FldRRCc8xlK
InChI InChI=1S/C19H13NO/c20-14-15-6-8-16(9-7-15)17-10-12-19(13-11-17)21-18-4-2-1-3-5-18/h1-13H
InChIKey QESVBBCZVALZEQ-UHFFFAOYSA-N
Mol Weight 271.32 g/mol
Molecular Formula C19H13NO
Exact Mass 271.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nqXrkS5Q0
Name 4'-Phenoxy-[1,1'-biphenyl]-4-carbonitrile
Appearance Colorless oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 271.099714042 u
Formula C19H13NO
InChI InChI=1S/C19H13NO/c20-14-15-6-8-16(9-7-15)17-10-12-19(13-11-17)21-18-4-2-1-3-5-18/h1-13H
InChIKey QESVBBCZVALZEQ-UHFFFAOYSA-N
Instrument Name Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.202005282
Molecular Weight 271.319 g/mol
Quality 208
SMILES C1(=CC=CC=C1)OC1=CC=C(C=C1)C1=CC=C(C=C1)C#N
SPLASH splash10-05fr-1190000000-1f980311cf8a83eaf148
Source of Spectrum QE-27-SM20-2n (DOI: 10.1002/chem.202005282)
Thin-Layer Chromatography 0.14 (hexane/EtOAc, 98:2, UV, KMnO4, PAA)
Wiley ID 1901951