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9-Benzyl-1-cyano-4-methoxy-.beta.-carboline
SpectraBase Compound ID IOw4D50UZpU
InChI InChI=1S/C20H15N3O/c1-24-18-12-22-16(11-21)20-19(18)15-9-5-6-10-17(15)23(20)13-14-7-3-2-4-8-14/h2-10,12H,13H2,1H3
InChIKey RDGOYJKBUWPSJY-UHFFFAOYSA-N
Mol Weight 313.36 g/mol
Molecular Formula C20H15N3O
Exact Mass 313.121512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ChdxJj3Q4vu
Name 9-Benzyl-1-cyano-4-methoxy-.beta.-carboline
Alternate Name(s) 9-benzyl-4-methoxy-9H-.beta.-carboline-1-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C20H15N3O
InChI InChI=1S/C20H15N3O/c1-24-18-12-22-16(11-21)20-19(18)15-9-5-6-10-17(15)23(20)13-14-7-3-2-4-8-14/h2-10,12H,13H2,1H3
InChIKey RDGOYJKBUWPSJY-UHFFFAOYSA-N
Molecular Weight 313.360 g/mol
SMILES c12[n](c3c(c2c(OC)cnc1C#N)cccc3)Cc1ccccc1
SPLASH splash10-0006-9003000000-35bacc23dbad7ab2f423
Source of Spectrum F-53-1604-16
Wiley ID 800494