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(2E,4E)-6-Oxo-2,4-utridecadienenitrile

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

(2E,4E)-6-Oxo-2,4-utridecadienenitrile
SpectraBase Compound ID 2cdVcQTQofl
InChI InChI=1S/C13H19NO/c1-2-3-4-5-7-10-13(15)11-8-6-9-12-14/h6,8-9,11H,2-5,7,10H2,1H3/b9-6+,11-8+
InChIKey CXLYQEVDNAEWSP-DNLSTQPZSA-N
Mol Weight 205.3 g/mol
Molecular Formula C13H19NO
Exact Mass 205.146664 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5fl7O0z8Cwa
Name (2E,4E)-6-oxo-2,4-Utridecadienenitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 205.146664235 u
Formula C13H19NO
InChI InChI=1S/C13H19NO/c1-2-3-4-5-7-10-13(15)11-8-6-9-12-14/h6,8-9,11H,2-5,7,10H2,1H3/b9-6+,11-8+
InChIKey CXLYQEVDNAEWSP-DNLSTQPZSA-N
Molecular Weight 205.301 g/mol
SMILES C(#N)\C=C\C=C\C(=O)CCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.96362