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[Sp, S]-1-Hydroxy-2-{1'-[N-(1"-<3-chlorophenyl>ethyl)imino]ethyl}-[2.2]paracyclophane
SpectraBase Compound ID 9UjZcR19rLF
InChI InChI=1S/C26H26ClNO/c1-17(23-4-3-5-24(27)16-23)28-18(2)25-21-12-10-19-6-8-20(9-7-19)11-13-22(15-14-21)26(25)29/h3-9,14-17,29H,10-13H2,1-2H3/b28-18+/t17-/m0/s1
InChIKey LBEGELUVRJREKC-DVRSNGFLSA-N
Mol Weight 403.95 g/mol
Molecular Formula C26H26ClNO
Exact Mass 403.170292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ITAj4P6XF48
Name [Sp, S]-1-Hydroxy-2-{1'-[N-(1"-<3-chlorophenyl>ethyl)imino]ethyl}-[2.2]paracyclophane
Alternate Name(s) [Rp, S]-1-Hydroxy-2-{1'-[N-(1''-<3-chlorophenyl>ethyl)imino]ethyl}-[2.2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26ClNO
InChI InChI=1S/C26H26ClNO/c1-17(23-4-3-5-24(27)16-23)28-18(2)25-21-12-10-19-6-8-20(9-7-19)11-13-22(15-14-21)26(25)29/h3-9,14-17,29H,10-13H2,1-2H3/b28-18+/t17-/m0/s1
InChIKey LBEGELUVRJREKC-DVRSNGFLSA-N
Molecular Weight 403.953 g/mol
SMILES Oc1c(\C(=N\[C@](c2cc(Cl)ccc2)(C)[H])C)c2ccc1CCc1ccc(CC2)cc1
SPLASH splash10-0udi-0220900000-90f3d2e6a187181f487f
Source of Spectrum QE-14-11552-Sp,S-12k
Wiley ID 1692548