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2(1H)-Quinolinone, octahydro-7-methyl-5-(2-pyridinylmethyl)-, N-oxide, (4a.alpha.,5.alpha.,7.alpha.,8a.beta.)-(.+-.)-
SpectraBase Compound ID 7giUsznALcq
InChI InChI=1S/C16H22N2O2/c1-11-8-12(10-13-4-2-3-7-17-13)14-5-6-16(19)18(20)15(14)9-11/h2-4,7,11-12,14-15,18H,5-6,8-10H2,1H3/t11-,12-,14-,15-/m0/s1
InChIKey RUOCDIJMOCLCMZ-JURCDPSOSA-N
Mol Weight 274.36 g/mol
Molecular Formula C16H22N2O2
Exact Mass 274.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNzTvDluVA8
Name 2(1H)-Quinolinone, octahydro-7-methyl-5-(2-pyridinylmethyl)-, N-oxide, (4a.alpha.,5.alpha.,7.alpha.,8a.beta.)-(.+-.)-
Alternate Name(s) (4aS,5S,7S,8aS)-7-methyl-5-(2-pyridinylmethyl)octahydro-2(1H)-quinolinone 1-oxide exo-5-(2-pyridyl-N-oxide)methyl-7-methylperhydroquinolin-2-one (isomer a)
CAS Registry Number 80063-75-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N2O2
InChI InChI=1S/C16H22N2O2/c1-11-8-12(10-13-4-2-3-7-17-13)14-5-6-16(19)18(20)15(14)9-11/h2-4,7,11-12,14-15,18H,5-6,8-10H2,1H3/t11-,12-,14-,15-/m0/s1
InChIKey RUOCDIJMOCLCMZ-JURCDPSOSA-N
Molecular Weight 274.364 g/mol
SMILES [NH+]1(C(CC[C@@]2([C@@]1(C[C@](C[C@]2(Cc1ncccc1)[H])(C)[H])[H])[H])=O)[O-]
SPLASH splash10-0btc-6930000000-fea67e12705d878f6106
Source of Spectrum I-59-2488-0
Wiley ID 1278302