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(1S,6R,1'S)-3-(1'-Phenylethyl)-3-azabicyclo[4.3.0]non-7-en-4-one
SpectraBase Compound ID AYiv6ghzLiP
InChI InChI=1S/C16H19NO/c1-12(13-6-3-2-4-7-13)17-11-15-9-5-8-14(15)10-16(17)18/h2-8,12,14-15H,9-11H2,1H3/t12-,14-,15+/m0/s1
InChIKey RSGWKZFCIZQVAC-AEGPPILISA-N
Mol Weight 241.33 g/mol
Molecular Formula C16H19NO
Exact Mass 241.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C0ufYETDnJ0
Name (1S,6R,1'S)-3-(1'-Phenylethyl)-3-azabicyclo[4.3.0]non-7-en-4-one
Alternate Name(s) (4aR,7aS)-2-[(1S)-1-phenylethyl]-1,2,4,4a,7,7a-hexahydro-3H-cyclopenta[c]pyridin-3-one
Comments Less than 3 mono-isotopic peaks
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Formula C16H19NO
InChI InChI=1S/C16H19NO/c1-12(13-6-3-2-4-7-13)17-11-15-9-5-8-14(15)10-16(17)18/h2-8,12,14-15H,9-11H2,1H3/t12-,14-,15+/m0/s1
InChIKey RSGWKZFCIZQVAC-AEGPPILISA-N
Molecular Weight 241.334 g/mol
SMILES C1(N(C[C@@]2([C@](C1)(C=CC2)[H])[H])[C@](c1ccccc1)(C)[H])=O
SPLASH splash10-0a4l-0970000000-9510ea6d3abcdb399d64
Source of Spectrum H-76-1600-17
Wiley ID 1244328