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Adamantane-1-carboxamide, N-(2-pentyl)-N-dodecyl-

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

Adamantane-1-carboxamide, N-(2-pentyl)-N-dodecyl-
SpectraBase Compound ID HlnM6JP2SgJ
InChI InChI=1S/C28H51NO/c1-4-6-7-8-9-10-11-12-13-14-16-29(23(3)15-5-2)27(30)28-20-24-17-25(21-28)19-26(18-24)22-28/h23-26H,4-22H2,1-3H3/t23?,24-,25+,26-,28-
InChIKey NURUNNDVCSPNBW-WCIVPIEASA-N
Mol Weight 417.7 g/mol
Molecular Formula C28H51NO
Exact Mass 417.397065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9XgzPvxSanC
Name Adamantane-1-carboxamide, N-(2-pentyl)-N-dodecyl-
Comments Computed using HOSE algorithm
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Exact Mass 417.397065265 u
Formula C28H51NO
InChI InChI=1S/C28H51NO/c1-4-6-7-8-9-10-11-12-13-14-16-29(23(3)15-5-2)27(30)28-20-24-17-25(21-28)19-26(18-24)22-28/h23-26H,4-22H2,1-3H3/t23?,24-,25+,26-,28-
InChIKey NURUNNDVCSPNBW-WCIVPIEASA-N
Molecular Weight 417.722 g/mol
SMILES C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(N(C(C)CCC)CCCCCCCCCCCC)=O