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19-Octacosenoic acid, pyrrolidide

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19-Octacosenoic acid, pyrrolidide
SpectraBase Compound ID 7Ing0O5p3QR
InChI InChI=1S/C32H61NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-29-32(34)33-30-27-28-31-33/h9-10H,2-8,11-31H2,1H3/b10-9-
InChIKey UHXWHPDDYBBMRV-KTKRTIGZSA-N
Mol Weight 475.8 g/mol
Molecular Formula C32H61NO
Exact Mass 475.475316 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID fKmQu9KKb7
Name 19-Octacosenoic acid, pyrrolidide
Comments Computed using HOSE algorithm
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Exact Mass 475.475315587 u
Formula C32H61NO
InChI InChI=1S/C32H61NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-29-32(34)33-30-27-28-31-33/h9-10H,2-8,11-31H2,1H3/b10-9-
InChIKey UHXWHPDDYBBMRV-KTKRTIGZSA-N
Molecular Weight 475.846 g/mol
SMILES C(N1CCCC1)(CCCCCCCCCCCCCCCCC\C=C/CCCCCCCC)=O