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5-(ALLYLTHIO)-4-PHENYL-4H-1,2,4-TRIAZOLE-3-ACETALDEHYDE, DIMETHYL ACETAL

View entire compound with spectra: 1 NMR, and 1 FTIR

5-(ALLYLTHIO)-4-PHENYL-4H-1,2,4-TRIAZOLE-3-ACETALDEHYDE, DIMETHYL ACETAL
SpectraBase Compound ID 9HU0TguTGiI
InChI InChI=1S/C15H19N3O2S/c1-4-10-21-15-17-16-13(11-14(19-2)20-3)18(15)12-8-6-5-7-9-12/h4-9,14H,1,10-11H2,2-3H3
InChIKey LDVBDBQWZCIOLV-UHFFFAOYSA-N
Mol Weight 305.4 g/mol
Molecular Formula C15H19N3O2S
Exact Mass 305.119798 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7YQgL05Z0PL
Name 5-(ALLYLTHIO)-4-PHENYL-4H-1,2,4-TRIAZOLE-3-ACETALDEHYDE, DIMETHYL ACETAL
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19N3O2S
InChI InChI=1S/C15H19N3O2S/c1-4-10-21-15-17-16-13(11-14(19-2)20-3)18(15)12-8-6-5-7-9-12/h4-9,14H,1,10-11H2,2-3H3
InChIKey LDVBDBQWZCIOLV-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 85-87C
Molecular Weight 305.40
Solvent CDCl3; Reference=TMS; Temperature 297K