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1,11-Undecanedioic acid, pyrrolidide
SpectraBase Compound ID GJUGAYoFKWg
InChI InChI=1S/C19H34N2O2/c22-18(20-14-8-9-15-20)12-6-4-2-1-3-5-7-13-19(23)21-16-10-11-17-21/h1-17H2
InChIKey OKSQMACTYXNPKY-UHFFFAOYSA-N
Mol Weight 322.5 g/mol
Molecular Formula C19H34N2O2
Exact Mass 322.262028 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BtcU5wsYX9z
Name 1,11-Undecanedioic acid, pyrrolidide
Comments Computed using HOSE algorithm
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Exact Mass 322.262028341 u
Formula C19H34N2O2
InChI InChI=1S/C19H34N2O2/c22-18(20-14-8-9-15-20)12-6-4-2-1-3-5-7-13-19(23)21-16-10-11-17-21/h1-17H2
InChIKey OKSQMACTYXNPKY-UHFFFAOYSA-N
Molecular Weight 322.493 g/mol
SMILES C1N(CCC1)C(CCCCCCCCCC(N1CCCC1)=O)=O