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(3S,4aR)-3,4a-Dimethyl-3,4,4a,5,6,7-hexahydroquinolin-2(1H)-one
SpectraBase Compound ID KlEjzwxvsUK
InChI InChI=1S/C11H17NO/c1-8-7-11(2)6-4-3-5-9(11)12-10(8)13/h5,8H,3-4,6-7H2,1-2H3,(H,12,13)/t8-,11+/m0/s1
InChIKey IHCVJGPEEBTINR-GZMMTYOYSA-N
Mol Weight 179.26 g/mol
Molecular Formula C11H17NO
Exact Mass 179.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LTy4Ww5BP2E
Name (3S,4aR)-3,4a-Dimethyl-3,4,4a,5,6,7-hexahydroquinolin-2(1H)-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17NO
InChI InChI=1S/C11H17NO/c1-8-7-11(2)6-4-3-5-9(11)12-10(8)13/h5,8H,3-4,6-7H2,1-2H3,(H,12,13)/t8-,11+/m0/s1
InChIKey IHCVJGPEEBTINR-GZMMTYOYSA-N
Molecular Weight 179.263 g/mol
SMILES N1C([C@](C[C@@]2(C1=CCCC2)C)(C)[H])=O
SPLASH splash10-03fr-2900000000-e0105ee2938ea66dba9c
Source of Spectrum QC-6-1808-9
Synonyms (3S,4aR)-3,4a-dimethyl-3,4,4a,5,6,7-hexahydro-2(1H)-quinolinone
Wiley ID 868947