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(2S,8aR)-1-Benzoyl-5-methyl-2-propyl-1,2,3,4,6,7,8,8a-octahydroquinolin-6-one
SpectraBase Compound ID 1GvSKpcUAqA
InChI InChI=1S/C20H25NO2/c1-3-7-16-10-11-17-14(2)19(22)13-12-18(17)21(16)20(23)15-8-5-4-6-9-15/h4-6,8-9,16,18H,3,7,10-13H2,1-2H3/t16-,18+/m0/s1
InChIKey HQIZJXNQRZFCHQ-FUHWJXTLSA-N
Mol Weight 311.43 g/mol
Molecular Formula C20H25NO2
Exact Mass 311.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dbzrlq0LLrK
Name (2S,8aR)-1-Benzoyl-5-methyl-2-propyl-1,2,3,4,6,7,8,8a-octahydroquinolin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H25NO2
InChI InChI=1S/C20H25NO2/c1-3-7-16-10-11-17-14(2)19(22)13-12-18(17)21(16)20(23)15-8-5-4-6-9-15/h4-6,8-9,16,18H,3,7,10-13H2,1-2H3/t16-,18+/m0/s1
InChIKey HQIZJXNQRZFCHQ-FUHWJXTLSA-N
Molecular Weight 311.425 g/mol
SMILES [C@]12(N([C@](CCC2=C(C)C(CC1)=O)(CCC)[H])C(=O)c1ccccc1)[H]
SPLASH splash10-0a6r-5900000000-6415bcec89a70af84331
Source of Spectrum KC-0-1122-33
Synonyms (2S,8aR)-1-benzoyl-5-methyl-2-propyl-1,3,4,7,8,8a-hexahydro-6(2H)-quinolinone
Wiley ID 785670