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(Octahydroquinolizin-1-yl)methyl 3-bromobenzoate
SpectraBase Compound ID HIYnKM9568c
InChI InChI=1S/C17H22BrNO2/c18-15-7-3-5-13(11-15)17(20)21-12-14-6-4-10-19-9-2-1-8-16(14)19/h3,5,7,11,14,16H,1-2,4,6,8-10,12H2
InChIKey AGZJPXXQAWUYDC-UHFFFAOYSA-N
Mol Weight 352.27 g/mol
Molecular Formula C17H22BrNO2
Exact Mass 351.083392 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KIqgcK1WFuO
Name (Octahydroquinolizin-1-yl)methyl 3-bromobenzoate
Alternate Name(s) 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 3-bromanylbenzoate 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 3-bromobenzoate 3-Bromobenzoic acid 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl ester 3-Bromobenzoic acid quinolizidin-1-ylmethyl ester Octahydro-2H-quinolizin-1-ylmethyl 3-bromobenzoate
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Formula C17H22BrNO2
InChI InChI=1S/C17H22BrNO2/c18-15-7-3-5-13(11-15)17(20)21-12-14-6-4-10-19-9-2-1-8-16(14)19/h3,5,7,11,14,16H,1-2,4,6,8-10,12H2
InChIKey AGZJPXXQAWUYDC-UHFFFAOYSA-N
Molecular Weight 352.272 g/mol
SMILES C1CC(C2N(C1)CCCC2)COC(=O)c1cc(ccc1)Br
SPLASH splash10-0udi-9600000000-4f614bd28be6d1d45727
Wiley ID 1468461