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1-Aminocyclopentanecarboxylic acid, N-methoxycarbonyl-, pentadecyl ester
SpectraBase Compound ID 6ZEk60OnFhO
InChI InChI=1S/C23H43NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-20-28-21(25)23(18-15-16-19-23)24-22(26)27-2/h3-20H2,1-2H3,(H,24,26)
InChIKey JMSSYXIISVNQBT-UHFFFAOYSA-N
Mol Weight 397.6 g/mol
Molecular Formula C23H43NO4
Exact Mass 397.319209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3DApwg4vLqu
Name 1-Aminocyclopentanecarboxylic acid, N-methoxycarbonyl-, pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 397.319208865 u
Formula C23H43NO4
InChI InChI=1S/C23H43NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-20-28-21(25)23(18-15-16-19-23)24-22(26)27-2/h3-20H2,1-2H3,(H,24,26)
InChIKey JMSSYXIISVNQBT-UHFFFAOYSA-N
Molecular Weight 397.600 g/mol
SMILES COC(NC1(C(OCCCCCCCCCCCCCCC)=O)CCCC1)=O