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4-Bromo-5-(N,N-dibenzylamino)-2-phenylpentane-1-nitrile
SpectraBase Compound ID FhORAHuuYBh
InChI InChI=1S/C25H25BrN2/c26-25(16-24(17-27)23-14-8-3-9-15-23)20-28(18-21-10-4-1-5-11-21)19-22-12-6-2-7-13-22/h1-15,24-25H,16,18-20H2
InChIKey BZGDFEQWGSZNOB-UHFFFAOYSA-N
Mol Weight 433.39 g/mol
Molecular Formula C25H25BrN2
Exact Mass 432.120112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LRqraZptE5h
Name 4-Bromo-5-(N,N-dibenzylamino)-2-phenylpentane-1-nitrile
Alternate Name(s) 5-[bis(phenylmethyl)amino]-4-bromo-2-phenylpentanenitrile 4-bromo-5-(dibenzylamino)-2-phenylpentanenitrile 4-bromo-5-(dibenzylamino)-2-phenyl-pentanenitrile 5-[bis(phenylmethyl)amino]-4-bromanyl-2-phenyl-pentanenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C25H25BrN2
InChI InChI=1S/C25H25BrN2/c26-25(16-24(17-27)23-14-8-3-9-15-23)20-28(18-21-10-4-1-5-11-21)19-22-12-6-2-7-13-22/h1-15,24-25H,16,18-20H2
InChIKey BZGDFEQWGSZNOB-UHFFFAOYSA-N
Molecular Weight 433.393 g/mol
SMILES C(#N)C(CC(CN(Cc1ccccc1)Cc1ccccc1)Br)c1ccccc1
SPLASH splash10-0udi-0009100000-77175f4cb854db9d5517
Source of Spectrum F5-7-3275-5a
Wiley ID 1696720