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Valeramide, N-allyl-N-(3-methylbutyl)-5-phenyl-
SpectraBase Compound ID 7gEQ5mD7lLK
InChI InChI=1S/C19H29NO/c1-4-15-20(16-14-17(2)3)19(21)13-9-8-12-18-10-6-5-7-11-18/h4-7,10-11,17H,1,8-9,12-16H2,2-3H3
InChIKey HSMSITQZIJLRJQ-UHFFFAOYSA-N
Mol Weight 287.45 g/mol
Molecular Formula C19H29NO
Exact Mass 287.224915 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8vwMZSw4IXk
Name Valeramide, N-allyl-N-(3-methylbutyl)-5-phenyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 287.224914557 u
Formula C19H29NO
InChI InChI=1S/C19H29NO/c1-4-15-20(16-14-17(2)3)19(21)13-9-8-12-18-10-6-5-7-11-18/h4-7,10-11,17H,1,8-9,12-16H2,2-3H3
InChIKey HSMSITQZIJLRJQ-UHFFFAOYSA-N
SMILES C(N(CCC(C)C)CC=C)(=O)CCCCC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.971618