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Benzamide, 3-methyl-N-(2-phenylethyl)-N-(3-methylbutyl)-
SpectraBase Compound ID Ldkrh3wpWSg
InChI InChI=1S/C21H27NO/c1-17(2)12-14-22(15-13-19-9-5-4-6-10-19)21(23)20-11-7-8-18(3)16-20/h4-11,16-17H,12-15H2,1-3H3
InChIKey IRTYDVQBNYLFCF-UHFFFAOYSA-N
Mol Weight 309.45 g/mol
Molecular Formula C21H27NO
Exact Mass 309.209264 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DyRYdq3miAR
Name Benzamide, 3-methyl-N-(2-phenylethyl)-N-(3-methylbutyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.209264492 u
Formula C21H27NO
InChI InChI=1S/C21H27NO/c1-17(2)12-14-22(15-13-19-9-5-4-6-10-19)21(23)20-11-7-8-18(3)16-20/h4-11,16-17H,12-15H2,1-3H3
InChIKey IRTYDVQBNYLFCF-UHFFFAOYSA-N
Molecular Weight 309.453 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C=CC=C(C)C1)CCC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.922715