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1H-5,8a-Propanoquinolin-7(8H)-one, hexahydro-1-(3-hydroxypropyl)-10-methyl-, (4a.alpha.,5.alpha.,8a.alpha.,10R*)-(.+-.)-
SpectraBase Compound ID O0BoxLIWBX
InChI InChI=1S/C16H27NO2/c1-12-8-13-9-14(19)11-16(10-12)15(13)4-2-5-17(16)6-3-7-18/h12-13,15,18H,2-11H2,1H3/t12-,13+,15+,16-/m1/s1
InChIKey YCNYNASSMKILCM-BFJAYTPKSA-N
Mol Weight 265.4 g/mol
Molecular Formula C16H27NO2
Exact Mass 265.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CJBv2MNpGeF
Name 1H-5,8a-Propanoquinolin-7(8H)-one, hexahydro-1-(3-hydroxypropyl)-10-methyl-, (4a.alpha.,5.alpha.,8a.alpha.,10R*)-(.+-.)-
Alternate Name(s) (1R,6S,7R,12R)-2-(3-hydroxypropyl)-12-methyl-2-azatricyclo[5.3.3.0(1,6)]tridecan-9-one (4aRS,5SR,8aSR,10RS)-1-(3-hydroxypropyl)-10-methylhexahydro-1H-5,8a-pronoquinolin-7(8H)-one
CAS Registry Number 69060-88-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H27NO2
InChI InChI=1S/C16H27NO2/c1-12-8-13-9-14(19)11-16(10-12)15(13)4-2-5-17(16)6-3-7-18/h12-13,15,18H,2-11H2,1H3/t12-,13+,15+,16-/m1/s1
InChIKey YCNYNASSMKILCM-BFJAYTPKSA-N
Molecular Weight 265.397 g/mol
SMILES OCCCN1[C@@]23[C@]([C@@]([H])(C[C@](C3)(C)[H])CC(C2)=O)(CCC1)[H]
SPLASH splash10-0a4i-0090000000-f246098bb60dbd495cf9
Source of Spectrum C-104-1063-0
Wiley ID 1269095