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Adamantane-1-carboxamide, N-allyl-N-pentyl-
SpectraBase Compound ID 9PmIWbHbIEY
InChI InChI=1S/C19H31NO/c1-3-5-6-8-20(7-4-2)18(21)19-12-15-9-16(13-19)11-17(10-15)14-19/h4,15-17H,2-3,5-14H2,1H3/t15-,16+,17-,19-
InChIKey FCGXUNJEOXRDCV-SXOLKLDHSA-N
Mol Weight 289.46 g/mol
Molecular Formula C19H31NO
Exact Mass 289.240565 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8n1GwBHT7oM
Name Adamantane-1-carboxamide, N-allyl-N-pentyl-
Comments Computed using HOSE algorithm
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Exact Mass 289.240564621 u
Formula C19H31NO
InChI InChI=1S/C19H31NO/c1-3-5-6-8-20(7-4-2)18(21)19-12-15-9-16(13-19)11-17(10-15)14-19/h4,15-17H,2-3,5-14H2,1H3/t15-,16+,17-,19-
InChIKey FCGXUNJEOXRDCV-SXOLKLDHSA-N
Molecular Weight 289.463 g/mol
SMILES C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(N(CCCCC)CC=C)=O