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1-[5-(4-CHLOROPHENYL)-1,3,4-THIADIAZOL-2-YLSULFONYL]-4-METHYL-PIPERAZINE
SpectraBase Compound ID 6yhI0NkkIBa
InChI InChI=1S/C23H15Cl2N5O4S4/c1-14-4-2-3-5-19(14)30(37(31,32)22-28-26-20(35-22)15-6-10-17(24)11-7-15)38(33,34)23-29-27-21(36-23)16-8-12-18(25)13-9-16/h2-13H,1H3
InChIKey UQOZBRDWKQNPME-UHFFFAOYSA-N
Mol Weight 624.6 g/mol
Molecular Formula C23H15Cl2N5O4S4
Exact Mass 622.938394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID XCPj2oFJNI
Name 1-[5-(4-CHLOROPHENYL)-1,3,4-THIADIAZOL-2-YLSULFONYL]-4-METHYL-PIPERAZINE
Compound Number 7H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H15Cl2N5O4S4
InChI InChI=1S/C23H15Cl2N5O4S4/c1-14-4-2-3-5-19(14)30(37(31,32)22-28-26-20(35-22)15-6-10-17(24)11-7-15)38(33,34)23-29-27-21(36-23)16-8-12-18(25)13-9-16/h2-13H,1H3
InChIKey UQOZBRDWKQNPME-UHFFFAOYSA-N
Literature Reference Author Z.CHEN,W.XU,K.LIU,S.YANG,H.FAN,P.S.BHADURY,D.Y.HU,Y.ZHANG
Literature Reference Citation MOLECULES,15,9046(2010)
Literature Reference DOI 10.3390/molecules15129046
Molecular Weight 624.549 g/mol
Sample ID 72756
Solvent DMSO-D6