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2-(3-Phenoxyphenyl)propionitrile

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2-(3-Phenoxyphenyl)propionitrile
SpectraBase Compound ID Bj8AKSSvY2S
InChI InChI=1S/C15H13NO/c1-12(11-16)13-6-5-9-15(10-13)17-14-7-3-2-4-8-14/h2-10,12H,1H3
InChIKey JSCONFOVXYGOST-UHFFFAOYSA-N
Mol Weight 223.27 g/mol
Molecular Formula C15H13NO
Exact Mass 223.099714 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID qAl1GbjPLp
Name 2-(3-Phenoxyphenyl)propionitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 223.099714042 u
Formula C15H13NO
InChI InChI=1S/C15H13NO/c1-12(11-16)13-6-5-9-15(10-13)17-14-7-3-2-4-8-14/h2-10,12H,1H3
InChIKey JSCONFOVXYGOST-UHFFFAOYSA-N
Molecular Weight 223.275 g/mol
SMILES C(C(C)C1=CC(=CC=C1)OC1=CC=CC=C1)#N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.822574