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Pyrrolidine, 1-(9,10,12-trihydroxy-1-oxooctadecyl)-
SpectraBase Compound ID HgCa097zIRc
InChI InChI=1S/C22H43NO4/c1-2-3-4-8-13-19(24)18-21(26)20(25)14-9-6-5-7-10-15-22(27)23-16-11-12-17-23/h19-21,24-26H,2-18H2,1H3
InChIKey QPSHLFSEVFERBK-UHFFFAOYSA-N
Mol Weight 385.6 g/mol
Molecular Formula C22H43NO4
Exact Mass 385.319209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOCPxYJaNRe
Name Pyrrolidine, 1-(9,10,12-trihydroxy-1-oxooctadecyl)-
Alternate Name(s) 18-oxo-18-(1-pyrrolidinyl)-7,9,10-octadecanetriol 9,10,12-Trihydroxyoctadecanoic acid methyl ester
CAS Registry Number 74327-84-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H43NO4
InChI InChI=1S/C22H43NO4/c1-2-3-4-8-13-19(24)18-21(26)20(25)14-9-6-5-7-10-15-22(27)23-16-11-12-17-23/h19-21,24-26H,2-18H2,1H3
InChIKey QPSHLFSEVFERBK-UHFFFAOYSA-N
Molecular Weight 385.589 g/mol
SMILES OC(CC(C(CCCCCCCC(N1CCCC1)=O)O)O)CCCCCC
SPLASH splash10-08mi-8920000000-d72955c7ba1b8f46df9a
Source of Spectrum KO-6-464-4
Wiley ID 1362273