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Pent-4-enoylamide, 2-methyl-N-(2-pentyl)-N-octadecyl-
SpectraBase Compound ID 4D2OfgviyTc
InChI InChI=1S/C29H57NO/c1-6-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-30(28(5)25-8-3)29(31)27(4)24-7-2/h7,27-28H,2,6,8-26H2,1,3-5H3
InChIKey HGMNUSIVAUSAQU-UHFFFAOYSA-N
Mol Weight 435.8 g/mol
Molecular Formula C29H57NO
Exact Mass 435.444015 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID De74eU4NoQR
Name Pent-4-enoylamide, 2-methyl-N-(2-pentyl)-N-octadecyl-
Comments Computed using HOSE algorithm
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Exact Mass 435.444015458 u
Formula C29H57NO
InChI InChI=1S/C29H57NO/c1-6-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-30(28(5)25-8-3)29(31)27(4)24-7-2/h7,27-28H,2,6,8-26H2,1,3-5H3
InChIKey HGMNUSIVAUSAQU-UHFFFAOYSA-N
Molecular Weight 435.781 g/mol
SMILES C(N(CCCCCCCCCCCCCCCCCC)C(CCC)C)(=O)C(C)CC=C