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2-Phenoxybutyric acid, (octahydroquinolizin-1-yl)methyl ester
SpectraBase Compound ID DERDOxBDiAk
InChI InChI=1S/C20H29NO3/c1-2-19(24-17-10-4-3-5-11-17)20(22)23-15-16-9-8-14-21-13-7-6-12-18(16)21/h3-5,10-11,16,18-19H,2,6-9,12-15H2,1H3
InChIKey RPUOHKOFHWSPMJ-UHFFFAOYSA-N
Mol Weight 331.46 g/mol
Molecular Formula C20H29NO3
Exact Mass 331.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ET6iPZyasi
Name 2-Phenoxybutyric acid, (octahydroquinolizin-1-yl)methyl ester
Alternate Name(s) 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 2-phenoxybutanoate 2-Phenoxybutanoic acid 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl ester 2-Phenoxybutyric acid quinolizidin-1-ylmethyl ester Octahydro-2H-quinolizin-1-ylmethyl 2-phenoxybutanoate
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Formula C20H29NO3
InChI InChI=1S/C20H29NO3/c1-2-19(24-17-10-4-3-5-11-17)20(22)23-15-16-9-8-14-21-13-7-6-12-18(16)21/h3-5,10-11,16,18-19H,2,6-9,12-15H2,1H3
InChIKey RPUOHKOFHWSPMJ-UHFFFAOYSA-N
Molecular Weight 331.456 g/mol
SMILES c1ccc(OC(C(OCC2C3N(CCC2)CCCC3)=O)CC)cc1
SPLASH splash10-0udi-6900000000-5046c8ce7ddf88b6dd29
Wiley ID 1444036