![3-Pentenenitrile, 5-[4-(1,1-dimethylethyl)phenyl]-4-methyl-](/api/spectrum/J9iihYReXql/structure.png?h=300&w=458 "3-Pentenenitrile, 5-[4-(1,1-dimethylethyl)phenyl]-4-methyl-")
| SpectraBase Compound ID | 4zQgrZ56sv0 |
|---|---|
| InChI | InChI=1S/C16H21N/c1-13(6-5-11-17)12-14-7-9-15(10-8-14)16(2,3)4/h6-10H,5,12H2,1-4H3/b13-6+ |
| InChIKey | HWXOSPKNTZLCIQ-AWNIVKPZSA-N |
| Mol Weight | 227.35 g/mol |
| Molecular Formula | C16H21N |
| Exact Mass | 227.1674 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | J9iihYReXql |
|---|---|
| Name | 3-Pentenenitrile, 5-[4-(1,1-dimethylethyl)phenyl]-4-methyl- |
| CAS Registry Number | 133735-89-4 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C16H21N |
| InChI | InChI=1S/C16H21N/c1-13(6-5-11-17)12-14-7-9-15(10-8-14)16(2,3)4/h6-10H,5,12H2,1-4H3/b13-6+ |
| InChIKey | HWXOSPKNTZLCIQ-AWNIVKPZSA-N |
| Instrument Name | Bruker IFS 85 |
| Purity | slightly contaminated |
| Technique | Cell |