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trans-N-Benzyl-2-methyl-3-acetoxy-4-methylenepiperidine isomer
SpectraBase Compound ID 6YLO26EfYZE
InChI InChI=1S/C16H21NO2/c1-12-9-10-17(11-15-7-5-4-6-8-15)13(2)16(12)19-14(3)18/h4-8,13,16H,1,9-11H2,2-3H3/t13-,16+/m0/s1
InChIKey JRANFZUPAVXEMX-XJKSGUPXSA-N
Mol Weight 259.35 g/mol
Molecular Formula C16H21NO2
Exact Mass 259.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2SGwuzgF02T
Name trans-N-Benzyl-2-methyl-3-acetoxy-4-methylenepiperidine isomer
Alternate Name(s) N-Benzyl-2-methyl-3-acetoxy-4-methylenepiperidine N-Benzyl-2-methyl-3-acetoxy-4-methylenepiperidine isomer (2S,3R)-N-Benzyl-2-methyl-3-acetoxy-4-methylenepiperidine isomer (2S,3R)-N-Benzyl-2-methyl-3-acetoxy-4-methylenepiperidine 1-Benzyl-2-methyl-4-methylene-3-piperidinyl acetate Acetic acid [(2S,3R)-2-methyl-4-methylene-1-(phenylmethyl)-3-piperidinyl] ester [(2S,3R)-1-benzyl-2-methyl-4-methylidenepiperidin-3-yl] acetate [(2S,3R)-1-benzyl-2-methyl-4-methylene-3-piperidyl] acetate [(2S,3R)-2-methyl-4-methylidene-1-(phenylmethyl)piperidin-3-yl] ethanoate
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Formula C16H21NO2
InChI InChI=1S/C16H21NO2/c1-12-9-10-17(11-15-7-5-4-6-8-15)13(2)16(12)19-14(3)18/h4-8,13,16H,1,9-11H2,2-3H3/t13-,16+/m0/s1
InChIKey JRANFZUPAVXEMX-XJKSGUPXSA-N
Molecular Weight 259.349 g/mol
SMILES [C@@]1(N(CCC([C@]1(OC(=O)C)[H])=C)Cc1ccccc1)(C)[H]
SPLASH splash10-0006-9230000000-8750b03ed839ba486273
Source of Spectrum J-63-851-25
Wiley ID 1262895