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5-(Benzylimino)-5-(4-fluorophenyl)pentanenitrile
SpectraBase Compound ID HkjpN390mmk
InChI InChI=1S/C18H17FN2/c19-17-11-9-16(10-12-17)18(8-4-5-13-20)21-14-15-6-2-1-3-7-15/h1-3,6-7,9-12H,4-5,8,14H2/b21-18+
InChIKey RHBCPDHNHMBUKJ-DYTRJAOYSA-N
Mol Weight 280.35 g/mol
Molecular Formula C18H17FN2
Exact Mass 280.137577 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DIIobmw4xon
Name 5-(Benzylimino)-5-(4-fluorophenyl)pentanenitrile
Alternate Name(s) (E)-5-(benzylimino)-5-(4-fluorophenyl)pentanenitrile
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Formula C18H17FN2
InChI InChI=1S/C18H17FN2/c19-17-11-9-16(10-12-17)18(8-4-5-13-20)21-14-15-6-2-1-3-7-15/h1-3,6-7,9-12H,4-5,8,14H2/b21-18+
InChIKey RHBCPDHNHMBUKJ-DYTRJAOYSA-N
Literature Reference DOI 10.1002/anie.201302460
Molecular Weight 280.346 g/mol
SMILES c1cc(\C(=N\Cc2ccccc2)CCCC#N)ccc1F
SPLASH splash10-0006-9070000000-8676d6353c829e81d398
Source of Spectrum ACI-52-SMS6-1e
Wiley ID 1781491