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Valeramide, 2-methyl-N-(2-phenylethyl)-N-nonyl-
SpectraBase Compound ID 58ihDtlJE8O
InChI InChI=1S/C23H39NO/c1-4-6-7-8-9-10-14-19-24(23(25)21(3)15-5-2)20-18-22-16-12-11-13-17-22/h11-13,16-17,21H,4-10,14-15,18-20H2,1-3H3
InChIKey SGDCZDCDFRXMIG-UHFFFAOYSA-N
Mol Weight 345.6 g/mol
Molecular Formula C23H39NO
Exact Mass 345.303165 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2RBatarTITF
Name Valeramide, 2-methyl-N-(2-phenylethyl)-N-nonyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.303164879 u
Formula C23H39NO
InChI InChI=1S/C23H39NO/c1-4-6-7-8-9-10-14-19-24(23(25)21(3)15-5-2)20-18-22-16-12-11-13-17-22/h11-13,16-17,21H,4-10,14-15,18-20H2,1-3H3
InChIKey SGDCZDCDFRXMIG-UHFFFAOYSA-N
Molecular Weight 345.571 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C(CCC)C)CCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.957255