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Hexanoylamide, 2-ethyl-N-benzyl-N-dodecyl-

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

Hexanoylamide, 2-ethyl-N-benzyl-N-dodecyl-
SpectraBase Compound ID 9R9ib1MQOvw
InChI InChI=1S/C27H47NO/c1-4-7-9-10-11-12-13-14-15-19-23-28(24-25-20-17-16-18-21-25)27(29)26(6-3)22-8-5-2/h16-18,20-21,26H,4-15,19,22-24H2,1-3H3
InChIKey ZPPIVIHBYAUPOB-UHFFFAOYSA-N
Mol Weight 401.7 g/mol
Molecular Formula C27H47NO
Exact Mass 401.365765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6grNxHFrqTM
Name Hexanoylamide, 2-ethyl-N-benzyl-N-dodecyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.365765136 u
Formula C27H47NO
InChI InChI=1S/C27H47NO/c1-4-7-9-10-11-12-13-14-15-19-23-28(24-25-20-17-16-18-21-25)27(29)26(6-3)22-8-5-2/h16-18,20-21,26H,4-15,19,22-24H2,1-3H3
InChIKey ZPPIVIHBYAUPOB-UHFFFAOYSA-N
Molecular Weight 401.679 g/mol
SMILES C(N(CCCCCCCCCCCC)CC1=CC=CC=C1)(=O)C(CC)CCCC