![1H-1,2,4-Triazole-1-acetonitrile, alpha-[butoxy(2-methylphenyl)methylene]-](/api/spectrum/8qmXSvDmGLO/structure.png?h=300&w=458 "1H-1,2,4-Triazole-1-acetonitrile, alpha-[butoxy(2-methylphenyl)methylene]-")
| SpectraBase Compound ID | HJ5zvtYz0N7 |
|---|---|
| InChI | InChI=1S/C16H18N4O/c1-3-4-9-21-16(14-8-6-5-7-13(14)2)15(10-17)20-12-18-11-19-20/h5-8,11-12H,3-4,9H2,1-2H3/b16-15- |
| InChIKey | PAAAWCIXPISRQY-NXVVXOECSA-N |
| Mol Weight | 282.35 g/mol |
| Molecular Formula | C16H18N4O |
| Exact Mass | 282.148061 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 8qmXSvDmGLO |
|---|---|
| Name | 1H-1,2,4-Triazole-1-acetonitrile, alpha-[butoxy(2-methylphenyl)methylene]- |
| CAS Registry Number | 133570-86-2 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C16H18N4O |
| InChI | InChI=1S/C16H18N4O/c1-3-4-9-21-16(14-8-6-5-7-13(14)2)15(10-17)20-12-18-11-19-20/h5-8,11-12H,3-4,9H2,1-2H3/b16-15- |
| InChIKey | PAAAWCIXPISRQY-NXVVXOECSA-N |
| Instrument Name | Bruker IFS 85 |
| Purity | slightly contaminated |
| Technique | Film |