![1H-1,2,4-Triazole-1-acetonitrile, alpha-[(4-chlorophenyl)(phenylthio)methyl]-](/api/spectrum/3vue1EH3leG/structure.png?h=300&w=458 "1H-1,2,4-Triazole-1-acetonitrile, alpha-[(4-chlorophenyl)(phenylthio)methyl]-")
| SpectraBase Compound ID | 3KCbMDJibM4 |
|---|---|
| InChI | InChI=1S/C17H13ClN4S/c18-14-8-6-13(7-9-14)17(23-15-4-2-1-3-5-15)16(10-19)22-12-20-11-21-22/h1-9,11-12,16-17H |
| InChIKey | DREBJASNLLVCMY-UHFFFAOYSA-N |
| Mol Weight | 340.83 g/mol |
| Molecular Formula | C17H13ClN4S |
| Exact Mass | 340.054945 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 3vue1EH3leG |
|---|---|
| Name | 1H-1,2,4-Triazole-1-acetonitrile, alpha-[(4-chlorophenyl)(phenylthio)methyl]- |
| CAS Registry Number | 101807-15-2 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C17H13ClN4S |
| InChI | InChI=1S/C17H13ClN4S/c18-14-8-6-13(7-9-14)17(23-15-4-2-1-3-5-15)16(10-19)22-12-20-11-21-22/h1-9,11-12,16-17H |
| InChIKey | DREBJASNLLVCMY-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |