| SpectraBase Compound ID | J3jJ6hlq1E |
|---|---|
| InChI | InChI=1S/C13H11NO2/c1-10(12(9-14)13(15)16)7-8-11-5-3-2-4-6-11/h2-8H,1H3,(H,15,16)/b8-7+,12-10+ |
| InChIKey | BLQMNKUEJQHKBV-DCXZXJRMSA-N |
| Mol Weight | 213.24 g/mol |
| Molecular Formula | C13H11NO2 |
| Exact Mass | 213.078979 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | Bp5esIQmrZI |
|---|---|
| Name | 2,4-Pentadienoic acid, 2-cyano-3-methyl-5-phenyl- |
| CAS Registry Number | 54681-21-9 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H11NO2 |
| InChI | InChI=1S/C13H11NO2/c1-10(12(9-14)13(15)16)7-8-11-5-3-2-4-6-11/h2-8H,1H3,(H,15,16)/b8-7+,12-10+ |
| InChIKey | BLQMNKUEJQHKBV-DCXZXJRMSA-N |
| Instrument Name | Bruker IFS 85 |
| Purity | slightly contaminated |
| Technique | KBr-Pellet |