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9-Phenanthrenamine, 4b,5,6,7,8,8a,9,10-octahydro-3-methoxy-4b-methyl-, (4b.alpha.,8a.alpha.,9.alpha.)-(.+-.)-
SpectraBase Compound ID KZYUAqtecEV
InChI InChI=1S/C16H23NO/c1-16-8-4-3-5-13(16)15(17)9-11-6-7-12(18-2)10-14(11)16/h6-7,10,13,15H,3-5,8-9,17H2,1-2H3/t13-,15+,16-/m0/s1
InChIKey MHMQOLITLJUAEG-IMJJTQAJSA-N
Mol Weight 245.37 g/mol
Molecular Formula C16H23NO
Exact Mass 245.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L4Z6HG90FNd
Name 9-Phenanthrenamine, 4b,5,6,7,8,8a,9,10-octahydro-3-methoxy-4b-methyl-, (4b.alpha.,8a.alpha.,9.alpha.)-(.+-.)-
CAS Registry Number 94272-68-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO
InChI InChI=1S/C16H23NO/c1-16-8-4-3-5-13(16)15(17)9-11-6-7-12(18-2)10-14(11)16/h6-7,10,13,15H,3-5,8-9,17H2,1-2H3/t13-,15+,16-/m0/s1
InChIKey MHMQOLITLJUAEG-IMJJTQAJSA-N
Molecular Weight 245.366 g/mol
SMILES N[C@]1([C@]2([C@](c3c(ccc(c3)OC)C1)(C)CCCC2)[H])[H]
SPLASH splash10-06vi-3190000000-96de9c2cd8c54ab9ffb5
Source of Spectrum H-67-1600-0
Synonyms (4bS,8aR,9R)-3-methoxy-4b-methyl-4b,5,6,7,8,8a,9,10-octahydro-9-phenanthrenamine (4bS,8aR,9R)-3-methoxy-4b-methyl-4b,5,6,7,8,8a,9,10-octahydro-9-phenanthrenylamine 3-Methoxy-4b-methyl-cis-4b-,5,6,7,8,8a,9,10-octahydrophenanthrene-9-amino adduct of hydrogenmalonate (isomer a)
Wiley ID 1248202