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3-[(2-chloro-6-fluorobenzyl)thio]-4-(p-chlorophenyl)-5-cyclopropyl-4H-1,2,4-triazole
SpectraBase Compound ID AImvMjCeRnZ
InChI InChI=1S/C18H14Cl2FN3S/c19-12-6-8-13(9-7-12)24-17(11-4-5-11)22-23-18(24)25-10-14-15(20)2-1-3-16(14)21/h1-3,6-9,11H,4-5,10H2
InChIKey SEHWPBYSBYFZHD-UHFFFAOYSA-N
Mol Weight 394.3 g/mol
Molecular Formula C18H14Cl2FN3S
Exact Mass 393.026952 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L9G5zGtztMo
Name 3-[(2-CHLORO-6-FLUOROBENZYL)THIO]-4-(p-CHLOROPHENYL)-5-CYCLOPROPYL-4H-1,2,4-TRIAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14Cl2FN3S
InChI InChI=1S/C18H14Cl2FN3S/c19-12-6-8-13(9-7-12)24-17(11-4-5-11)22-23-18(24)25-10-14-15(20)2-1-3-16(14)21/h1-3,6-9,11H,4-5,10H2
InChIKey SEHWPBYSBYFZHD-UHFFFAOYSA-N
Melting Point 117-119C
Molecular Weight 394.30
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms TRIAZOLE, 4H-1,2,4-, 3-//2-CHLORO- 6-FLUOROBENZYL/THIO/-4-/P-CHLOROPHENYL/-5-CYCLOPROPYL-,