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N,N',N''-Tritosyldiethylenetriamine

View entire compound with spectra: 2 NMR, 1 FTIR, and 2 MS (GC)

N,N',N''-Tritosyldiethylenetriamine
SpectraBase Compound ID 94Q3PGG7V4U
InChI InChI=1S/C25H31N3O6S3/c1-20-4-10-23(11-5-20)35(29,30)26-16-18-28(37(33,34)25-14-8-22(3)9-15-25)19-17-27-36(31,32)24-12-6-21(2)7-13-24/h4-15,26-27H,16-19H2,1-3H3
InChIKey OCDIAWYQMCPHAM-UHFFFAOYSA-N
Mol Weight 565.72 g/mol
Molecular Formula C25H31N3O6S3
Exact Mass 565.137499 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IQz4VqWw0Ru
Name N,N',N''-Tritosyldiethylenetriamine
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 370509
CAS Registry Number 56187-04-3
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H31N3O6S3
InChI InChI=1S/C25H31N3O6S3/c1-20-4-10-23(11-5-20)35(29,30)26-16-18-28(37(33,34)25-14-8-22(3)9-15-25)19-17-27-36(31,32)24-12-6-21(2)7-13-24/h4-15,26-27H,16-19H2,1-3H3
InChIKey OCDIAWYQMCPHAM-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 4-methyl-N-[2-[(4-methylphenyl)sulfonyl-[2-[(4-methylphenyl)sulfonylamino]ethyl]amino]ethyl]benzenesulfonamide NSC694885
Wiley ID SIAL_13CNMR_007931