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12-Bromo-4-hydroxy-5[1-(1-phenyl-ethylimino)-ethyl]-[2.2]paracyclophane
SpectraBase Compound ID 9mtN4OAquBl
InChI InChI=1S/C26H26BrNO/c1-17(20-6-4-3-5-7-20)28-18(2)25-22-13-12-21-10-8-19(16-24(21)27)9-11-23(15-14-22)26(25)29/h3-8,10,14-17,29H,9,11-13H2,1-2H3/b28-18+/t17-/m0/s1
InChIKey UHXSUTVUAUXXRM-DVRSNGFLSA-N
Mol Weight 448.4 g/mol
Molecular Formula C26H26BrNO
Exact Mass 447.119777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DLcfAASY0cc
Name 12-Bromo-4-hydroxy-5[1-(1-phenyl-ethylimino)-ethyl]-[2.2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26BrNO
InChI InChI=1S/C26H26BrNO/c1-17(20-6-4-3-5-7-20)28-18(2)25-22-13-12-21-10-8-19(16-24(21)27)9-11-23(15-14-22)26(25)29/h3-8,10,14-17,29H,9,11-13H2,1-2H3/b28-18+/t17-/m0/s1
InChIKey UHXSUTVUAUXXRM-DVRSNGFLSA-N
Molecular Weight 448.404 g/mol
SMILES Oc1c(\C(=N\[C@](c2ccccc2)(C)[H])C)c2CCc3c(cc(CCc1cc2)cc3)Br
SPLASH splash10-03xr-0950000000-1baa6775a821de223218
Source of Spectrum QC-21-736-7
Wiley ID 1688421