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1,2,4-Thiadiazole-3,5(2H,4H)-diimine, n(sup 3),n(sup 5)-bis(4-methylphenyl)-2,4-dimethyl-

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

1,2,4-Thiadiazole-3,5(2H,4H)-diimine, n(sup 3),n(sup 5)-bis(4-methylphenyl)-2,4-dimethyl-
SpectraBase Compound ID 5onTFgBvcCp
InChI InChI=1S/C18H20N4S/c1-13-5-9-15(10-6-13)19-17-21(3)18(23-22(17)4)20-16-11-7-14(2)8-12-16/h5-12H,1-4H3/b19-17+,20-18-
InChIKey IYFOFTPTPBBPHD-NADBREJJSA-N
Mol Weight 324.45 g/mol
Molecular Formula C18H20N4S
Exact Mass 324.140868 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4vwfBwveNJ
Name 1,2,4-Thiadiazole-3,5(2H,4H)-diimine, N(sup 3),N(sup 5)-bis(4-methylphenyl)-2,4-dimethyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.140867834 u
Formula C18H20N4S
InChI InChI=1S/C18H20N4S/c1-13-5-9-15(10-6-13)19-17-21(3)18(23-22(17)4)20-16-11-7-14(2)8-12-16/h5-12H,1-4H3/b19-17+,20-18-
InChIKey IYFOFTPTPBBPHD-NADBREJJSA-N
Molecular Weight 324.446 g/mol
SMILES CN1\C(N(\C(S1)=N\C=1C=CC(=CC1)C)C)=N/C=1C=CC(=CC1)C