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9,10-Epoxy-octadec-12,13-enoic acid, pyrrolidide

View entire compound with spectra: 1 NMR, and 1 FTIR

9,10-Epoxy-octadec-12,13-enoic acid, pyrrolidide
SpectraBase Compound ID EilwrTiIV7M
InChI InChI=1S/C22H39NO2/c1-2-3-4-5-7-10-15-20-21(25-20)16-11-8-6-9-12-17-22(24)23-18-13-14-19-23/h7,10,20-21H,2-6,8-9,11-19H2,1H3/b10-7-
InChIKey JUWQACPXMHUFTR-YFHOEESVSA-N
Mol Weight 349.6 g/mol
Molecular Formula C22H39NO2
Exact Mass 349.298079 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GIoJyz4ZbPu
Name 9,10-Epoxy-octadec-12,13-enoic acid, pyrrolidide
Comments Computed using HOSE algorithm
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Exact Mass 349.298079498 u
Formula C22H39NO2
InChI InChI=1S/C22H39NO2/c1-2-3-4-5-7-10-15-20-21(25-20)16-11-8-6-9-12-17-22(24)23-18-13-14-19-23/h7,10,20-21H,2-6,8-9,11-19H2,1H3/b10-7-
InChIKey JUWQACPXMHUFTR-YFHOEESVSA-N
Molecular Weight 349.559 g/mol
SMILES C(N1CCCC1)(CCCCCCCC1C(C\C=C/CCCCC)O1)=O