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Octanamide, N-(2-ethylphenyl)-

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Octanamide, N-(2-ethylphenyl)-
SpectraBase Compound ID 22IOwAhWHxB
InChI InChI=1S/C16H25NO/c1-3-5-6-7-8-13-16(18)17-15-12-10-9-11-14(15)4-2/h9-12H,3-8,13H2,1-2H3,(H,17,18)
InChIKey ZCSMXOKLJYHILX-UHFFFAOYSA-N
Mol Weight 247.38 g/mol
Molecular Formula C16H25NO
Exact Mass 247.193614 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GyifmIXYe6X
Name Octanamide, N-(2-ethylphenyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 247.193614428 u
Formula C16H25NO
InChI InChI=1S/C16H25NO/c1-3-5-6-7-8-13-16(18)17-15-12-10-9-11-14(15)4-2/h9-12H,3-8,13H2,1-2H3,(H,17,18)
InChIKey ZCSMXOKLJYHILX-UHFFFAOYSA-N
Molecular Weight 247.382 g/mol
SMILES C(CCCC)CCC(=O)NC=1C(CC)=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.906957