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7-Methyl-9,10-bis(oxidanylidene)anthracene-1-carbonitrile

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

7-Methyl-9,10-bis(oxidanylidene)anthracene-1-carbonitrile
SpectraBase Compound ID EYcrkQLw4xQ
InChI InChI=1S/C16H9NO2/c1-9-5-6-11-13(7-9)16(19)14-10(8-17)3-2-4-12(14)15(11)18/h2-7H,1H3
InChIKey DWWKGOSYXGRICK-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C16H9NO2
Exact Mass 247.063329 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KisIqZxyCoD
Name 7-Methyl-9,10-bis(oxidanylidene)anthracene-1-carbonitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 247.063328532 u
Formula C16H9NO2
InChI InChI=1S/C16H9NO2/c1-9-5-6-11-13(7-9)16(19)14-10(8-17)3-2-4-12(14)15(11)18/h2-7H,1H3
InChIKey DWWKGOSYXGRICK-UHFFFAOYSA-N
Molecular Weight 247.253 g/mol
SMILES C1(C2=C(C=CC(=C2)C)C(C=2C1=C(C#N)C=CC2)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.826081