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1-(4-BUTYLPHENYL)-3-BUTYL-5-(2-BENZOTHIAZOLYL)-FORMAZAN
SpectraBase Compound ID 7aZeLxmXMly
InChI InChI=1S/C22H27N5S/c1-3-5-9-17-13-15-18(16-14-17)24-25-21(12-6-4-2)26-27-22-23-19-10-7-8-11-20(19)28-22/h7-8,10-11,13-16H,3-6,9,12H2,1-2H3,(H,23,27)/b25-24+,26-21-
InChIKey KMLWWDYFHNYXLQ-VVEBWWBVSA-N
Mol Weight 393.55 g/mol
Molecular Formula C22H27N5S
Exact Mass 393.198717 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DDAgIddfcd2
Name (1E,2Z,3Z)-1-(4-BUTYLPHENYL)-3-BUTYL-5-(2-BENZTHIAZOLYL)FORMAZAN
Comments <1
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Formula C22H27N5S
InChI InChI=1S/C22H27N5S/c1-3-5-9-17-13-15-18(16-14-17)24-25-21(12-6-4-2)26-27-22-23-19-10-7-8-11-20(19)28-22/h7-8,10-11,13-16H,3-6,9,12H2,1-2H3,(H,23,27)/b25-24+,26-21-
InChIKey KMLWWDYFHNYXLQ-VVEBWWBVSA-N
Instrument Name Varian XL-100
Literature Reference L.V.SHMELEV, I.P.PERVOVA, G.N.LIPUNOVA, L.I.RISINOVA, A.V.KESSENIKH,I.N.LIPUNOV (1992) Koord.Khim.(Russ. Lang.): v.18, N3, 312-318.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d