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15-{[1'-Phenylethyl)amino]methyl}-[2.2]paracyclophan-4-ol
SpectraBase Compound ID 7knTAQuJwX1
InChI InChI=1S/C25H27NO/c1-18(21-5-3-2-4-6-21)26-17-24-15-19-7-8-20-10-12-23(25(27)16-20)14-13-22(24)11-9-19/h2-6,9-12,15-16,18,26-27H,7-8,13-14,17H2,1H3/t18-/m1/s1
InChIKey QBKAWKPUVZUUCY-GOSISDBHSA-N
Mol Weight 357.5 g/mol
Molecular Formula C25H27NO
Exact Mass 357.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6H81ybPXFUu
Name 15-{[1'-Phenylethyl)amino]methyl}-[2.2]paracyclophan-4-ol
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Formula C25H27NO
InChI InChI=1S/C25H27NO/c1-18(21-5-3-2-4-6-21)26-17-24-15-19-7-8-20-10-12-23(25(27)16-20)14-13-22(24)11-9-19/h2-6,9-12,15-16,18,26-27H,7-8,13-14,17H2,1H3/t18-/m1/s1
InChIKey QBKAWKPUVZUUCY-GOSISDBHSA-N
Molecular Weight 357.497 g/mol
SMILES Oc1c2CCc3c(CN[C@@](c4ccccc4)(C)[H])cc(CCc(c1)cc2)cc3
SPLASH splash10-0a59-0900000000-8d6590fef4a77e1efbd0
Source of Spectrum K1-2003-2060-0
Wiley ID 1521152