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1-Aminocyclopentanecarboxylic acid, N-(octyloxycarbonyl)-, butyl ester
SpectraBase Compound ID EwVGHafrDpB
InChI InChI=1S/C19H35NO4/c1-3-5-7-8-9-12-16-24-18(22)20-19(13-10-11-14-19)17(21)23-15-6-4-2/h3-16H2,1-2H3,(H,20,22)
InChIKey WPRRKVIPRAJUTL-UHFFFAOYSA-N
Mol Weight 341.5 g/mol
Molecular Formula C19H35NO4
Exact Mass 341.256609 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 92USfaZvnS7
Name 1-Aminocyclopentanecarboxylic acid, N-(octyloxycarbonyl)-, butyl ester
Comments Computed using HOSE algorithm
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Exact Mass 341.256608607 u
Formula C19H35NO4
InChI InChI=1S/C19H35NO4/c1-3-5-7-8-9-12-16-24-18(22)20-19(13-10-11-14-19)17(21)23-15-6-4-2/h3-16H2,1-2H3,(H,20,22)
InChIKey WPRRKVIPRAJUTL-UHFFFAOYSA-N
Molecular Weight 341.492 g/mol
SMILES C1CC(C(OCCCC)=O)(NC(=O)OCCCCCCCC)CC1