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1-Aminocyclopentanecarboxylic acid, N-(but-3-en-1-yloxycarbonyl)-, octyl ester
SpectraBase Compound ID GhEMPkrlIZD
InChI InChI=1S/C19H33NO4/c1-3-5-7-8-9-12-16-23-17(21)19(13-10-11-14-19)20-18(22)24-15-6-4-2/h4H,2-3,5-16H2,1H3,(H,20,22)
InChIKey DKPFUQPMUUQFLW-UHFFFAOYSA-N
Mol Weight 339.5 g/mol
Molecular Formula C19H33NO4
Exact Mass 339.240959 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID If3QsbdKZqG
Name 1-Aminocyclopentanecarboxylic acid, N-(but-3-en-1-yloxycarbonyl)-, octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 339.240958543 u
Formula C19H33NO4
InChI InChI=1S/C19H33NO4/c1-3-5-7-8-9-12-16-23-17(21)19(13-10-11-14-19)20-18(22)24-15-6-4-2/h4H,2-3,5-16H2,1H3,(H,20,22)
InChIKey DKPFUQPMUUQFLW-UHFFFAOYSA-N
Molecular Weight 339.476 g/mol
SMILES C1CC(C(OCCCCCCCC)=O)(NC(=O)OCCC=C)CC1