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(Z)-N-((E)-1-cyclohexyl-4-(cyclohexylimino)-3-pentylazetidin-2-ylidene)-4-methylbenzenesulfonamide
SpectraBase Compound ID J7XFINYvdxG
InChI InChI=1S/C27H41N3O2S/c1-3-4-7-16-25-26(28-22-12-8-5-9-13-22)30(23-14-10-6-11-15-23)27(25)29-33(31,32)24-19-17-21(2)18-20-24/h17-20,22-23,25H,3-16H2,1-2H3/b28-26+,29-27-
InChIKey YBWOQZNLEJWIRU-ZTCSZMBZSA-N
Mol Weight 471.7 g/mol
Molecular Formula C27H41N3O2S
Exact Mass 471.291949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G6zkCpsNA6n
Name (Z)-N-((E)-1-cyclohexyl-4-(cyclohexylimino)-3-pentylazetidin-2-ylidene)-4-methylbenzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H41N3O2S
InChI InChI=1S/C27H41N3O2S/c1-3-4-7-16-25-26(28-22-12-8-5-9-13-22)30(23-14-10-6-11-15-23)27(25)29-33(31,32)24-19-17-21(2)18-20-24/h17-20,22-23,25H,3-16H2,1-2H3/b28-26+,29-27-
InChIKey YBWOQZNLEJWIRU-ZTCSZMBZSA-N
Literature Reference DOI 10.1021/ol070485x
Molecular Weight 471.704 g/mol
SMILES C1(\C(=N\S(=O)(=O)c2ccc(cc2)C)N(C2CCCCC2)\C1=N/C1CCCCC1)CCCCC
SPLASH splash10-0006-5829000000-7a742f1fda2c55457c73
Source of Spectrum A1-9-1585/SMS3-4e
Wiley ID 1758112