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4-Piperidinone, 2-(3-methoxyphenyl)-3-methyl-, trans-
SpectraBase Compound ID LrQcWsv3xPE
InChI InChI=1S/C13H17NO2/c1-9-12(15)6-7-14-13(9)10-4-3-5-11(8-10)16-2/h3-5,8-9,13-14H,6-7H2,1-2H3/t9-,13-/m0/s1
InChIKey WIPDHRHKHOIEGQ-ZANVPECISA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GowohAKVQx7
Name 4-Piperidinone, 2-(3-methoxyphenyl)-3-methyl-, trans-
Alternate Name(s) (2S,3R)-2-(3-methoxyphenyl)-3-methyl-4-piperidinone (2S,3R)-2-(3-methoxyphenyl)-3-methyl-4-piperidone (2S,3R)-2-(3-methoxyphenyl)-3-methyl-piperidin-4-one
CAS Registry Number 81835-75-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-9-12(15)6-7-14-13(9)10-4-3-5-11(8-10)16-2/h3-5,8-9,13-14H,6-7H2,1-2H3/t9-,13-/m0/s1
InChIKey WIPDHRHKHOIEGQ-ZANVPECISA-N
Molecular Weight 219.284 g/mol
SMILES N1CCC([C@@]([C@]1(c1cc(OC)ccc1)[H])(C)[H])=O
SPLASH splash10-03yj-2920000000-6481d097a12e6dfa8395
Source of Spectrum Y-20-601-5
Wiley ID 1218898