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(2E)-N-[5-(2-Bromophenyl)-1,3,4-thiadiazol-2-yl]-3-(4-heptylphenyl)-2-propenamide
SpectraBase Compound ID 3egfHWxOgUi
InChI InChI=1S/C24H26BrN3OS/c1-2-3-4-5-6-9-18-12-14-19(15-13-18)16-17-22(29)26-24-28-27-23(30-24)20-10-7-8-11-21(20)25/h7-8,10-17H,2-6,9H2,1H3,(H,26,28,29)/b17-16+
InChIKey IBTLYIRPHODDJH-WUKNDPDISA-N
Mol Weight 484.46 g/mol
Molecular Formula C24H26BrN3OS
Exact Mass 483.097997 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7F7n4E8Q56
Name 2-(2-BROMOPHENYL)-5-(4-HEPTYLCINNAMAMIDO)-1,3,4-THIADIAZOLE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H26BrN3OS
InChI InChI=1S/C24H26BrN3OS/c1-2-3-4-5-6-9-18-12-14-19(15-13-18)16-17-22(29)26-24-28-27-23(30-24)20-10-7-8-11-21(20)25/h7-8,10-17H,2-6,9H2,1H3,(H,26,28,29)/b17-16+
InChIKey IBTLYIRPHODDJH-WUKNDPDISA-N
Molecular Weight 483.0974
SMILES N(C(\C=C\c1ccc(CCCCCCC)cc1)=O)c1sc(-c2ccccc2Br)nn1
SPLASH splash10-0006-9310000000-d205b1497c27b66bd4c6
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany