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Hexanamide, 3,5,5-trimethyl-N-benzyl-N-heptyl-

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

Hexanamide, 3,5,5-trimethyl-N-benzyl-N-heptyl-
SpectraBase Compound ID GJKHRGxDswB
InChI InChI=1S/C23H39NO/c1-6-7-8-9-13-16-24(19-21-14-11-10-12-15-21)22(25)17-20(2)18-23(3,4)5/h10-12,14-15,20H,6-9,13,16-19H2,1-5H3
InChIKey UZLDAWOKMPNVOE-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 2xZjiM1i5R9
Name Hexanamide, 3,5,5-trimethyl-N-benzyl-N-heptyl-
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/c1-6-7-8-9-13-16-24(19-21-14-11-10-12-15-21)22(25)17-20(2)18-23(3,4)5/h10-12,14-15,20H,6-9,13,16-19H2,1-5H3
InChIKey UZLDAWOKMPNVOE-UHFFFAOYSA-N
Molecular Weight 345.571 g/mol
SMILES C(N(CCCCCCC)CC1=CC=CC=C1)(=O)CC(C)CC(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.950916