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4-[(1S)-2-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-1-yl]butanenitrile
SpectraBase Compound ID 1VSU1SeNM3N
InChI InChI=1S/C19H19FN2/c20-16-8-10-17(11-9-16)22-14-12-15-5-1-2-6-18(15)19(22)7-3-4-13-21/h1-2,5-6,8-11,19H,3-4,7,12,14H2/t19-/m0/s1
InChIKey LAVHWLSAHOOTRK-IBGZPJMESA-N
Mol Weight 294.37 g/mol
Molecular Formula C19H19FN2
Exact Mass 294.153227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LURyk36xvJe
Name 4-[(1S)-2-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-1-yl]butanenitrile
Appearance Yellow oily liquid
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Formula C19H19FN2
InChI InChI=1S/C19H19FN2/c20-16-8-10-17(11-9-16)22-14-12-15-5-1-2-6-18(15)19(22)7-3-4-13-21/h1-2,5-6,8-11,19H,3-4,7,12,14H2/t19-/m0/s1
InChIKey LAVHWLSAHOOTRK-IBGZPJMESA-N
Instrument Name LRMS
Ionization Type EI
Molecular Weight 294.373 g/mol
SMILES c1c2c(ccc1)[C@@](N(CC2)c1ccc(cc1)F)(CCCC#N)[H]
SPLASH splash10-004i-0090000000-f92ad694673db9b55fe9
Source of Spectrum CN114478380A
Wiley ID 1884267