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Isovaleramide, N-benzyl-N-octyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

Isovaleramide, N-benzyl-N-octyl-
SpectraBase Compound ID 1ZviE3KmW7J
InChI InChI=1S/C20H33NO/c1-4-5-6-7-8-12-15-21(20(22)16-18(2)3)17-19-13-10-9-11-14-19/h9-11,13-14,18H,4-8,12,15-17H2,1-3H3
InChIKey KDFLWIHJJKVYNK-UHFFFAOYSA-N
Mol Weight 303.5 g/mol
Molecular Formula C20H33NO
Exact Mass 303.256215 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HDayhJwGOnx
Name Isovaleramide, N-benzyl-N-octyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 303.256214686 u
Formula C20H33NO
InChI InChI=1S/C20H33NO/c1-4-5-6-7-8-12-15-21(20(22)16-18(2)3)17-19-13-10-9-11-14-19/h9-11,13-14,18H,4-8,12,15-17H2,1-3H3
InChIKey KDFLWIHJJKVYNK-UHFFFAOYSA-N
SMILES C(N(CCCCCCCC)CC1=CC=CC=C1)(=O)CC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.920967