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(+)-1,2,3,4a.alpha.,5,6,6a,9,9a,9b-Decahydro-6a.beta.-methyl-7-(3-pyridyl)-(4H)-cyclopenta[f]quinolin-3-one
SpectraBase Compound ID DFmAzmdqpuf
InChI InChI=1S/C18H22N2O/c1-18-9-8-16-13(4-7-17(21)20-16)15(18)6-5-14(18)12-3-2-10-19-11-12/h2-3,5,10-11,13,15-16H,4,6-9H2,1H3,(H,20,21)/t13?,15?,16?,18-/m1/s1
InChIKey RCINWACWEHWETM-ILEWXUCFSA-N
Mol Weight 282.39 g/mol
Molecular Formula C18H22N2O
Exact Mass 282.173213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5gIrQWQeqGo
Name (+)-1,2,3,4a.alpha.,5,6,6a,9,9a,9b-Decahydro-6a.beta.-methyl-7-(3-pyridyl)-(4H)-cyclopenta[f]quinolin-3-one
Alternate Name(s) (+)-1,2,3,4a.alpha.,5,6,6a,9,9a.alpha.,9b.beta.-Decahydro-6a.beta.-methyl-7-(3-pyridyl)-(4H)-cyclopenta[f]quinolin-3-one (6aS)-6a-methyl-7-(3-pyridinyl)-1,2,4,4a,5,6,6a,9,9a,9b-decahydro-3H-cyclopenta[f]quinolin-3-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22N2O
InChI InChI=1S/C18H22N2O/c1-18-9-8-16-13(4-7-17(21)20-16)15(18)6-5-14(18)12-3-2-10-19-11-12/h2-3,5,10-11,13,15-16H,4,6-9H2,1H3,(H,20,21)/t13?,15?,16?,18-/m1/s1
InChIKey RCINWACWEHWETM-ILEWXUCFSA-N
Molecular Weight 282.387 g/mol
SMILES N1C(CCC2C3CC=C([C@]3(CCC12)C)c1cnccc1)=O
SPLASH splash10-001i-9010000000-bc236feac0dba1c57b47
Source of Spectrum J-64-4988-12
Wiley ID 1530545