For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Ethyl 2[4-(4-octylphenyl)benzamido]-3-methylbutanoate(

View entire compound with spectra: 2 NMR

Ethyl 2[4-(4-octylphenyl)benzamido]-3-methylbutanoate(
SpectraBase Compound ID IpxOW5JgLGf
InChI InChI=1S/C28H39NO3/c1-5-7-8-9-10-11-12-22-13-15-23(16-14-22)24-17-19-25(20-18-24)27(30)29-26(21(3)4)28(31)32-6-2/h13-21,26H,5-12H2,1-4H3,(H,29,30)
InChIKey IWQCZIBITRWNJZ-UHFFFAOYSA-N
Mol Weight 437.6 g/mol
Molecular Formula C28H39NO3
Exact Mass 437.292994 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7S49plP3ZWl
Name Ethyl 2[4-(4-octylphenyl)benzamido]-3-methylbutanoate(
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 437.292994117 u
Formula C28H39NO3
InChI InChI=1S/C28H39NO3/c1-5-7-8-9-10-11-12-22-13-15-23(16-14-22)24-17-19-25(20-18-24)27(30)29-26(21(3)4)28(31)32-6-2/h13-21,26H,5-12H2,1-4H3,(H,29,30)
InChIKey IWQCZIBITRWNJZ-UHFFFAOYSA-N
Molecular Weight 437.624 g/mol
SMILES N(C(c1ccc(cc1)-c1ccc(cc1)CCCCCCCC)=O)C(C(=O)OCC)C(C)C