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N,N-bis{4-[(p-tolylsulfonyl)-2-butynyl]-4-bromo-m-toluidine

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N,N-bis{4-[(p-tolylsulfonyl)-2-butynyl]-4-bromo-m-toluidine
SpectraBase Compound ID IzPBVJ3ee8U
InChI InChI=1S/C29H28BrNO4S2/c1-23-8-13-27(14-9-23)36(32,33)20-6-4-18-31(26-12-17-29(30)25(3)22-26)19-5-7-21-37(34,35)28-15-10-24(2)11-16-28/h8-17,22H,18-21H2,1-3H3
InChIKey BTSIQWYRBJQGJC-UHFFFAOYSA-N
Mol Weight 598.57 g/mol
Molecular Formula C29H28BrNO4S2
Exact Mass 597.064314 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CZHCMfzsS9i
Name N,N-BIS[4-(p-TOLYLSULFONYL)-2-BUTYNYL]-4-BROMO-m-TOLUIDINE
Source of Sample B. S. Thyagarajan, University of Texas at San Antonio, San Antonio, Texas
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H28BrNO4S2
InChI InChI=1S/C29H28BrNO4S2/c1-23-8-13-27(14-9-23)36(32,33)20-6-4-18-31(26-12-17-29(30)25(3)22-26)19-5-7-21-37(34,35)28-15-10-24(2)11-16-28/h8-17,22H,18-21H2,1-3H3
InChIKey BTSIQWYRBJQGJC-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Molecular Weight 598.58
Solvent CDCl3; Reference=TMS; Temperature 297K