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N-isobutyl-4-phenoxybutyramide
SpectraBase Compound ID D3Nrzt7mPBb
InChI InChI=1S/C14H21NO2/c1-12(2)11-15-14(16)9-6-10-17-13-7-4-3-5-8-13/h3-5,7-8,12H,6,9-11H2,1-2H3,(H,15,16)
InChIKey ZUPCMKHGZOMFJM-UHFFFAOYSA-N
Mol Weight 235.33 g/mol
Molecular Formula C14H21NO2
Exact Mass 235.157229 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID HQaoCBJ0J3h
Name N-Isobutyl-4-phenoxybutyramide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.157228918 u
Formula C14H21NO2
InChI InChI=1S/C14H21NO2/c1-12(2)11-15-14(16)9-6-10-17-13-7-4-3-5-8-13/h3-5,7-8,12H,6,9-11H2,1-2H3,(H,15,16)
InChIKey ZUPCMKHGZOMFJM-UHFFFAOYSA-N
Molecular Weight 235.327 g/mol
SMILES N(C(CCCOC1=CC=CC=C1)=O)CC(C)C
Spectrum/Structure Validation Score (Raman) 0.970285