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2-(phenylmethyl)-6-[2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]-1H-benzimidazole
SpectraBase Compound ID 7hNVyIIRZQ8
InChI InChI=1S/C27H27F3N4/c28-27(29,30)22-7-4-8-23(19-22)34-15-13-33(14-16-34)12-11-21-9-10-24-25(17-21)32-26(31-24)18-20-5-2-1-3-6-20/h1-10,17,19H,11-16,18H2,(H,31,32)
InChIKey XRLXGKYZYJSGJF-UHFFFAOYSA-N
Mol Weight 464.54 g/mol
Molecular Formula C27H27F3N4
Exact Mass 464.218781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UQUtAN4cnj
Name 2-(phenylmethyl)-6-[2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]-1H-benzimidazole
Alternate Name(s) 2-(phenylmethyl)-6-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]-1H-benzimidazole 2-benzyl-6-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]-1H-benzimidazole 2-benzyl-6-[2-[4-[3-(trifluoromethyl)phenyl]piperazino]ethyl]-1H-benzimidazole
Comments Less than 3 mono-isotopic peaks
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Formula C27H27F3N4
InChI InChI=1S/C27H27F3N4/c28-27(29,30)22-7-4-8-23(19-22)34-15-13-33(14-16-34)12-11-21-9-10-24-25(17-21)32-26(31-24)18-20-5-2-1-3-6-20/h1-10,17,19H,11-16,18H2,(H,31,32)
InChIKey XRLXGKYZYJSGJF-UHFFFAOYSA-N
Molecular Weight 464.536 g/mol
SMILES [nH]1c2c(nc1Cc1ccccc1)cc(cc2)CCN1CCN(CC1)c1cc(C(F)(F)F)ccc1
SPLASH splash10-0006-0090100000-02a68e940181446218ec
Source of Spectrum D8-331-25-20
Wiley ID 1550652