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Glutaric acid, monoamide, N-(1-adamantyl)-, isobutyl ester

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Glutaric acid, monoamide, N-(1-adamantyl)-, isobutyl ester
SpectraBase Compound ID H1egLR8iAeh
InChI InChI=1S/C19H31NO3/c1-13(2)12-23-18(22)5-3-4-17(21)20-19-9-14-6-15(10-19)8-16(7-14)11-19/h13-16H,3-12H2,1-2H3,(H,20,21)/t14-,15+,16-,19-
InChIKey LPGCDOFLVHWFSH-HGYGSNGRSA-N
Mol Weight 321.46 g/mol
Molecular Formula C19H31NO3
Exact Mass 321.230394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5LEUp12pd8L
Name Glutaric acid, monoamide, N-(1-adamantyl)-, isobutyl ester
Comments Computed using HOSE algorithm
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Exact Mass 321.230393859 u
Formula C19H31NO3
InChI InChI=1S/C19H31NO3/c1-13(2)12-23-18(22)5-3-4-17(21)20-19-9-14-6-15(10-19)8-16(7-14)11-19/h13-16H,3-12H2,1-2H3,(H,20,21)/t14-,15+,16-,19-
InChIKey LPGCDOFLVHWFSH-HGYGSNGRSA-N
Molecular Weight 321.461 g/mol
SMILES CC(C)COC(CCCC(NC12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])=O)=O