![1H-1,2,4-Triazole-1-acetonitrile, alpha-[(4-chlorophenyl)hydroxymethylene]-](/api/spectrum/GhNGWCf63X9/structure.png?h=300&w=458 "1H-1,2,4-Triazole-1-acetonitrile, alpha-[(4-chlorophenyl)hydroxymethylene]-")
| SpectraBase Compound ID | JbWI0BMcMg3 |
|---|---|
| InChI | InChI=1S/C11H7ClN4O/c12-9-3-1-8(2-4-9)11(17)10(5-13)16-7-14-6-15-16/h1-4,6-7,17H/b11-10+ |
| InChIKey | HMUIUDDZHMFPBK-ZHACJKMWSA-N |
| Mol Weight | 246.66 g/mol |
| Molecular Formula | C11H7ClN4O |
| Exact Mass | 246.030839 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | GhNGWCf63X9 |
|---|---|
| Name | 1H-1,2,4-Triazole-1-acetonitrile, alpha-[(4-chlorophenyl)hydroxymethylene]- |
| CAS Registry Number | 133570-82-8 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H7ClN4O |
| InChI | InChI=1S/C11H7ClN4O/c12-9-3-1-8(2-4-9)11(17)10(5-13)16-7-14-6-15-16/h1-4,6-7,17H/b11-10+ |
| InChIKey | HMUIUDDZHMFPBK-ZHACJKMWSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |