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(1S,5S,6R,9R,1'S)-5,9-Dimethyl-3-(1'-phenylethyl)-3-azabicyclo[4.3.0]nonan-4-one
SpectraBase Compound ID 8TIFcCjuTY5
InChI InChI=1S/C18H25NO/c1-12-9-10-16-13(2)18(20)19(11-17(12)16)14(3)15-7-5-4-6-8-15/h4-8,12-14,16-17H,9-11H2,1-3H3/t12-,13+,14+,16+,17+/m1/s1
InChIKey GJFYJYLRTONWHU-HZRXROBNSA-N
Mol Weight 271.4 g/mol
Molecular Formula C18H25NO
Exact Mass 271.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FoGgOQbh0U4
Name (1S,5S,6R,9R,1'S)-5,9-Dimethyl-3-(1'-phenylethyl)-3-azabicyclo[4.3.0]nonan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO
InChI InChI=1S/C18H25NO/c1-12-9-10-16-13(2)18(20)19(11-17(12)16)14(3)15-7-5-4-6-8-15/h4-8,12-14,16-17H,9-11H2,1-3H3/t12-,13+,14+,16+,17+/m1/s1
InChIKey GJFYJYLRTONWHU-HZRXROBNSA-N
Molecular Weight 271.404 g/mol
SMILES C1(N(C[C@@]2([C@]([C@@]1(C)[H])(CC[C@]2(C)[H])[H])[H])[C@](c1ccccc1)(C)[H])=O
SPLASH splash10-0ab9-0890000000-edb66a4820bbd66a6b87
Source of Spectrum H-76-1605-30
Synonyms (4S,4aR,7R,7aS)-4,7-dimethyl-2-[(1S)-1-phenylethyl]octahydro-3H-cyclopenta[c]pyridin-3-one
Wiley ID 1275511