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cis-N-Methyl-6-oxo-m-anisyldecahydroisoquinoline
SpectraBase Compound ID 5McTOPdMalz
InChI InChI=1S/C17H23NO2/c1-18-9-8-12-10-14(19)6-7-16(12)17(18)13-4-3-5-15(11-13)20-2/h3-5,11-12,16-17H,6-10H2,1-2H3/t12-,16+,17?/m1/s1
InChIKey DVFMMTLZMHVEGH-KOEKDOOYSA-N
Mol Weight 273.38 g/mol
Molecular Formula C17H23NO2
Exact Mass 273.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5KJn1wcL7Tw
Name cis-N-Methyl-6-oxo-m-anisyldecahydroisoquinoline
Comments Less than 3 mono-isotopic peaks
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Formula C17H23NO2
InChI InChI=1S/C17H23NO2/c1-18-9-8-12-10-14(19)6-7-16(12)17(18)13-4-3-5-15(11-13)20-2/h3-5,11-12,16-17H,6-10H2,1-2H3/t12-,16+,17?/m1/s1
InChIKey DVFMMTLZMHVEGH-KOEKDOOYSA-N
Molecular Weight 273.376 g/mol
SMILES C1([C@@]2([C@](CC(CC2)=O)([H])CCN1C)[H])c1cc(OC)ccc1
SPLASH splash10-00di-9040000000-0511363eec5ae40e08c3
Source of Spectrum J-46-5068-2
Synonyms (4aR,8aS)-1-(3-methoxyphenyl)-2-methyloctahydro-6(2H)-isoquinolinone
Wiley ID 1277385