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Benzonitrile, 2-(2-cyclopropyl-2-oxoethoxy)-

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

Benzonitrile, 2-(2-cyclopropyl-2-oxoethoxy)-
SpectraBase Compound ID JbUUZmdlM93
InChI InChI=1S/C12H11NO2/c13-7-10-3-1-2-4-12(10)15-8-11(14)9-5-6-9/h1-4,9H,5-6,8H2
InChIKey QDKYOSXDWZEWAV-UHFFFAOYSA-N
Mol Weight 201.22 g/mol
Molecular Formula C12H11NO2
Exact Mass 201.078979 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8POTNiCZtc3
Name Benzonitrile, 2-(2-cyclopropyl-2-oxoethoxy)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 201.078978596 u
Formula C12H11NO2
InChI InChI=1S/C12H11NO2/c13-7-10-3-1-2-4-12(10)15-8-11(14)9-5-6-9/h1-4,9H,5-6,8H2
InChIKey QDKYOSXDWZEWAV-UHFFFAOYSA-N
Molecular Weight 201.225 g/mol
SMILES C1(CC1)C(COC1=CC=CC=C1C#N)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.971195