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(Z)-N-((E)-1-cyclohexyl-4-(cyclohexylimino)-3-phenylazetidin-2-ylidene)methanesulfonamide
SpectraBase Compound ID FeaxZblX3Rd
InChI InChI=1S/C22H31N3O2S/c1-28(26,27)24-22-20(17-11-5-2-6-12-17)21(23-18-13-7-3-8-14-18)25(22)19-15-9-4-10-16-19/h2,5-6,11-12,18-20H,3-4,7-10,13-16H2,1H3/b23-21+,24-22-
InChIKey BZDRUGPOFTWMBP-CFPQKXLCSA-N
Mol Weight 401.57 g/mol
Molecular Formula C22H31N3O2S
Exact Mass 401.213698 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lw1yz36LURc
Name (Z)-N-((E)-1-cyclohexyl-4-(cyclohexylimino)-3-phenylazetidin-2-ylidene)methanesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31N3O2S
InChI InChI=1S/C22H31N3O2S/c1-28(26,27)24-22-20(17-11-5-2-6-12-17)21(23-18-13-7-3-8-14-18)25(22)19-15-9-4-10-16-19/h2,5-6,11-12,18-20H,3-4,7-10,13-16H2,1H3/b23-21+,24-22-
InChIKey BZDRUGPOFTWMBP-CFPQKXLCSA-N
Literature Reference DOI 10.1021/ol070485x
Molecular Weight 401.569 g/mol
SMILES C1(\C(N(\C1=N/C1CCCCC1)C1CCCCC1)=N\S(C)(=O)=O)c1ccccc1
SPLASH splash10-06dj-3911000000-8a15bc621b26c662eca8
Source of Spectrum A1-9-1585/SMS5-4n
Wiley ID 1758121