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(1S,2S)-1-[N-(2,4,6-Triisopropylphenylsulfonyl)amino]-2-[N-(2-hydroxy-3,5-bis(t-butyl)benzylidene)amino]cyclohexane

View entire compound with spectra: 1 MS (GC)

(1S,2S)-1-[N-(2,4,6-Triisopropylphenylsulfonyl)amino]-2-[N-(2-hydroxy-3,5-bis(t-butyl)benzylidene)amino]cyclohexane
SpectraBase Compound ID Ho6q4ksfReX
InChI InChI=1S/C36H56N2O3S/c1-22(2)25-18-28(23(3)4)34(29(19-25)24(5)6)42(40,41)38-32-16-14-13-15-31(32)37-21-26-17-27(35(7,8)9)20-30(33(26)39)36(10,11)12/h17-24,31-32,38-39H,13-16H2,1-12H3/b37-21+/t31-,32-/m0/s1
InChIKey LOEXZZPSIDIDHS-ZCVXKGJDSA-N
Mol Weight 596.9 g/mol
Molecular Formula C36H56N2O3S
Exact Mass 596.401165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FQ82lyN27r3
Name (1S,2S)-1-[N-(2,4,6-Triisopropylphenylsulfonyl)amino]-2-[N-(2-hydroxy-3,5-bis(t-butyl)benzylidene)amino]cyclohexane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H56N2O3S
InChI InChI=1S/C36H56N2O3S/c1-22(2)25-18-28(23(3)4)34(29(19-25)24(5)6)42(40,41)38-32-16-14-13-15-31(32)37-21-26-17-27(35(7,8)9)20-30(33(26)39)36(10,11)12/h17-24,31-32,38-39H,13-16H2,1-12H3/b37-21+/t31-,32-/m0/s1
InChIKey LOEXZZPSIDIDHS-ZCVXKGJDSA-N
Molecular Weight 596.915 g/mol
SMILES N(S(c1c(cc(cc1C(C)C)C(C)C)C(C)C)(=O)=O)[C@@]1([C@@](\N=C\c2cc(cc(c2O)C(C)(C)C)C(C)(C)C)(CCCC1)[H])[H]
SPLASH splash10-0002-0000090000-a19636e5fd5790f21dc3
Source of Spectrum QC-9-4139-5
Synonyms N-((1S,2S)-2-{[(E)-(3,5-ditert-butyl-2-hydroxyphenyl)methylidene]amino}cyclohexyl)-2,4,6-triisopropylbenzenesulfonamide trans-1-[N-(2,4,6-Triisopropylphenylsulfonyl)amino]-2-[N-(2-hydroxy-3,5-bis(t-butyl)benzylidene)amino]cyclohexane
Wiley ID 870889