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2-Undecylacetanilide

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

2-Undecylacetanilide
SpectraBase Compound ID 21VCKnQZFjp
InChI InChI=1S/C19H31NO/c1-3-4-5-6-7-8-9-10-11-14-18-15-12-13-16-19(18)20-17(2)21/h12-13,15-16H,3-11,14H2,1-2H3,(H,20,21)
InChIKey YNHHFZYWIFHNMU-UHFFFAOYSA-N
Mol Weight 289.46 g/mol
Molecular Formula C19H31NO
Exact Mass 289.240565 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4wof5MHdnLD
Name 2-Undecylacetanilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.240564621 u
Formula C19H31NO
InChI InChI=1S/C19H31NO/c1-3-4-5-6-7-8-9-10-11-14-18-15-12-13-16-19(18)20-17(2)21/h12-13,15-16H,3-11,14H2,1-2H3,(H,20,21)
InChIKey YNHHFZYWIFHNMU-UHFFFAOYSA-N
Molecular Weight 289.463 g/mol
SMILES C=1(NC(=O)C)C(CCCCCCCCCCC)=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.829527