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3-Phenoxyphthalonitrile

View entire compound with spectra: 2 NMR, 2 FTIR, and 1 Raman

3-Phenoxyphthalonitrile
SpectraBase Compound ID IX0PpAneaBC
InChI InChI=1S/C14H8N2O/c15-9-11-5-4-8-14(13(11)10-16)17-12-6-2-1-3-7-12/h1-8H
InChIKey XTWFKMOELYYKGC-UHFFFAOYSA-N
Mol Weight 220.23 g/mol
Molecular Formula C14H8N2O
Exact Mass 220.063663 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IJawhY2CTAA
Name 3-Phenoxyphthalonitrile
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 418129
CAS Registry Number 77474-62-5
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8N2O
InChI 1S/C14H8N2O/c15-9-11-5-4-8-14(13(11)10-16)17-12-6-2-1-3-7-12/h1-8H
InChIKey XTWFKMOELYYKGC-UHFFFAOYSA-N
Observed nucleus 1H
Purity 98%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3-Phenoxy-1,2-benzenedicarbonitrile
Wiley ID SIAL_1HNMR_009201