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Propanenitrile, 3-(2-methylphenoxy)-,; propionitrile, 3-(o-tolyloxy)-
SpectraBase Compound ID J5voUt1WMBZ
InChI InChI=1S/C10H11NO/c1-9-5-2-3-6-10(9)12-8-4-7-11/h2-3,5-6H,4,8H2,1H3
InChIKey QNJKMBLSQHRIRU-UHFFFAOYSA-N
Mol Weight 161.2 g/mol
Molecular Formula C10H11NO
Exact Mass 161.084064 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID DWHbVqTNvg5
Name Propanenitrile, 3-(2-methylphenoxy)-,; propionitrile, 3-(o-tolyloxy)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 161.084063977 u
Formula C10H11NO
InChI InChI=1S/C10H11NO/c1-9-5-2-3-6-10(9)12-8-4-7-11/h2-3,5-6H,4,8H2,1H3
InChIKey QNJKMBLSQHRIRU-UHFFFAOYSA-N
Molecular Weight 161.204 g/mol
SMILES C1=C(C(=CC=C1)C)OCCC#N
Spectrum/Structure Validation Score (Raman) 0.963678