1-benzylidene-3-thiosemicarbazide
Compound with spectra: 6 NMR, 1 FTIR, and 5 MS (GC)
| SpectraBase Compound ID | 3DmRf14TouX |
|---|---|
| InChI | InChI=1S/C8H9N3S/c9-8(12)11-10-6-7-4-2-1-3-5-7/h1-6H,(H3,9,11,12)/b10-6+ |
| InChIKey | UYHCMAZIKNVDSX-UXBLZVDNSA-N |
| Mol Weight | 179.24 g/mol |
| Molecular Formula | C8H9N3S |
| Exact Mass | 179.051718 g/mol |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sherk Chemicals, Florence, Italy |
| Solvent | Polysol; Reference=TMS Spectrometer= Varian CFT-20 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | C2D6SO dimethylsulfo |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | Polysol |
| Copyright | Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | DMSO-d6 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Sherk Chemicals, Florence, Italy |
| Catalog Number | A 3 |
| Technique | KBr WAFER |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | T-68-1132-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | AD-0-2532-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | JX-2012-795 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | CBD-17-SM2-3a |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | JX-2012-796 |
- BENZALDEHYDE THIOSEMICARBAZONE
- UYHCMAZIKNVDSX-UXBLZVDNSA-N
- SEMICARBAZIDE, 1-BENZYLIDENE- 3-THIO-,
- 2-Benzylidenehydrazinecarbothioamide
- (2E)-2-Benzylidenehydrazine-1-carbothioamide
- benzene, [(E)-[(aminocarbonothioyl)hydrazono]methyl]-
| Title | Journal or Book | Year |
|---|---|---|
| Synthesis, NMR structural characterization and molecular modeling of substituted thiosemicarbazones and semicarbazones using DFT calculations to prove the syn/anti isomer formation | Magnetic Resonance in Chemistry | 2014 |
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