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(1R,5S,6S,9S)-3,5,9-Trimethyl-3-azabicyclo[4.3.0]nonan-8-one
SpectraBase Compound ID 6QLaE5VAx3E
InChI InChI=1S/C11H19NO/c1-7-5-12(3)6-10-8(2)11(13)4-9(7)10/h7-10H,4-6H2,1-3H3/t7-,8+,9+,10+/m1/s1
InChIKey QLZHMPAVGNWQMF-KATARQTJSA-N
Mol Weight 181.28 g/mol
Molecular Formula C11H19NO
Exact Mass 181.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7a6ET4iGTv
Name (1R,5S,6S,9S)-3,5,9-Trimethyl-3-azabicyclo[4.3.0]nonan-8-one
Alternate Name(s) (4S,4aS,7S,7aR)-2,4,7-trimethyloctahydro-6H-cyclopenta[c]pyridin-6-one (4S,4aS,7S,7aR)-2,4,7-trimethyl-3,4,4a,5,7,7a-hexahydro-1H-cyclopenta[c]pyridin-6-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H19NO
InChI InChI=1S/C11H19NO/c1-7-5-12(3)6-10-8(2)11(13)4-9(7)10/h7-10H,4-6H2,1-3H3/t7-,8+,9+,10+/m1/s1
InChIKey QLZHMPAVGNWQMF-KATARQTJSA-N
Molecular Weight 181.279 g/mol
SMILES [C@@]12([C@@](CC([C@]2(C)[H])=O)([C@](C)(CN(C1)C)[H])[H])[H]
SPLASH splash10-053r-6900000000-026c363254a924425614
Source of Spectrum H-76-1605-4
Wiley ID 1177640