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2-Benzoyl-1,2,3,4-tetrahydroisoquinoline-1-carbonitrile

View entire compound with spectra: 1 MS (GC)

2-Benzoyl-1,2,3,4-tetrahydroisoquinoline-1-carbonitrile
SpectraBase Compound ID IODMqu9F2ga
InChI InChI=1S/C17H14N2O/c18-12-16-15-9-5-4-6-13(15)10-11-19(16)17(20)14-7-2-1-3-8-14/h1-9,16H,10-11H2
InChIKey SUCYGZUQJXUYID-UHFFFAOYSA-N
Mol Weight 262.31 g/mol
Molecular Formula C17H14N2O
Exact Mass 262.110613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmSYxPtZyI1
Name 2-Benzoyl-1,2,3,4-tetrahydroisoquinoline-1-carbonitrile
Alternate Name(s) 2-(Phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-1-carbonitrile 2-Benzoyl-1,2,3,4-tetrahydro-1-isoquinolinecarbonitrile 2-Benzoyl-3,4-dihydro-1H-isoquinoline-1-carbonitrile
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Formula C17H14N2O
InChI InChI=1S/C17H14N2O/c18-12-16-15-9-5-4-6-13(15)10-11-19(16)17(20)14-7-2-1-3-8-14/h1-9,16H,10-11H2
InChIKey SUCYGZUQJXUYID-UHFFFAOYSA-N
Molecular Weight 262.312 g/mol
SMILES C(N1C(c2ccccc2CC1)C#N)(=O)c1ccccc1
SPLASH splash10-0bvi-5960000000-8beb8122d9b23db8463d
Source of Spectrum SB-136-199-7
Wiley ID 1612180