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Butyramide, 4-phenyl-N-propyl-N-hexyl-

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Butyramide, 4-phenyl-N-propyl-N-hexyl-
SpectraBase Compound ID G2JIMExgVqp
InChI InChI=1S/C19H31NO/c1-3-5-6-10-17-20(16-4-2)19(21)15-11-14-18-12-8-7-9-13-18/h7-9,12-13H,3-6,10-11,14-17H2,1-2H3
InChIKey QGDNTLMJNVODEP-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 5aanjLKLHk7
Name Butyramide, 4-phenyl-N-propyl-N-hexyl-
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/c1-3-5-6-10-17-20(16-4-2)19(21)15-11-14-18-12-8-7-9-13-18/h7-9,12-13H,3-6,10-11,14-17H2,1-2H3
InChIKey QGDNTLMJNVODEP-UHFFFAOYSA-N
Molecular Weight 289.463 g/mol
SMILES C(C(N(CCCCCC)CCC)=O)CCC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.981247