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2(1H)-Quinolinone, octahydro-7-methyl-5-[(1-methyl-2-piperidinyl)methyl]-, [4a.alpha.,5.beta.(S*),7.alpha.,8a.beta.]-(.+-.)-
SpectraBase Compound ID HQmJzL1Y6jj
InChI InChI=1S/C17H30N2O/c1-12-9-13(11-14-5-3-4-8-19(14)2)15-6-7-17(20)18-16(15)10-12/h12-16H,3-11H2,1-2H3,(H,18,20)/t12-,13+,14-,15-,16-/m0/s1
InChIKey MEVCSYCJDRPMBW-QRJUGERDSA-N
Mol Weight 278.44 g/mol
Molecular Formula C17H30N2O
Exact Mass 278.235814 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7hBWkQTLc1Q
Name 2(1H)-Quinolinone, octahydro-7-methyl-5-[(1-methyl-2-piperidinyl)methyl]-, [4a.alpha.,5.beta.(S*),7.alpha.,8a.beta.]-(.+-.)-
Alternate Name(s) (4aS,5R,7S,8aS)-7-methyl-5-{[(2S)-1-methylpiperidinyl]methyl}octahydro-2(1H)-quinolinone N-Methyl-5-(2-piperidinylmethyl)-7-methylperhydroquinolin-2-one (mixture ofisomers)
CAS Registry Number 80053-35-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30N2O
InChI InChI=1S/C17H30N2O/c1-12-9-13(11-14-5-3-4-8-19(14)2)15-6-7-17(20)18-16(15)10-12/h12-16H,3-11H2,1-2H3,(H,18,20)/t12-,13+,14-,15-,16-/m0/s1
InChIKey MEVCSYCJDRPMBW-QRJUGERDSA-N
Molecular Weight 278.440 g/mol
SMILES N1C(CC[C@@]2([C@@]1(C[C@](C[C@@]2(C[C@]1(N(C)CCCC1)[H])[H])(C)[H])[H])[H])=O
SPLASH splash10-0002-9020000000-ce9169e017b9f3f4e9b9
Source of Spectrum I-59-2489-0
Wiley ID 1282332