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Pentoxyverine-M (Desalkyl,AC)
SpectraBase Compound ID FNJtt1WgqIr
InChI InChI=1S/C20H29NO4/c1-3-21(17(2)22)13-14-24-15-16-25-19(23)20(11-7-8-12-20)18-9-5-4-6-10-18/h4-6,9-10H,3,7-8,11-16H2,1-2H3
InChIKey PPPROKQWJNBLCO-UHFFFAOYSA-N
Mol Weight 347.46 g/mol
Molecular Formula C20H29NO4
Exact Mass 347.209658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 98egCUMDYLw
Name 2-(2-(N-Ethylacetamido)ethoxy)ethyl 1-phenylcyclopentane-1-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 347.209658414 u
Formula C20H29NO4
InChI InChI=1S/C20H29NO4/c1-3-21(17(2)22)13-14-24-15-16-25-19(23)20(11-7-8-12-20)18-9-5-4-6-10-18/h4-6,9-10H,3,7-8,11-16H2,1-2H3
InChIKey PPPROKQWJNBLCO-UHFFFAOYSA-N
Molecular Weight 347.455 g/mol
SMILES C1=CC=CC(=C1)C1(C(OCCOCCN(CC)C(C)=O)=O)CCCC1