| SpectraBase Compound ID | 74DBKLgWZ23 |
|---|---|
| InChI | InChI=1S/C11H11NO2/c1-14-11(13)10(8-12)7-9-5-3-2-4-6-9/h2-6,10H,7H2,1H3 |
| InChIKey | LQAFHLCKDSSNNH-UHFFFAOYSA-N |
| Mol Weight | 189.21 g/mol |
| Molecular Formula | C11H11NO2 |
| Exact Mass | 189.078979 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | vUDNM6jEja |
|---|---|
| Name | BENZENEPROPANOIC ACID, alpha-CYANO-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H11NO2 |
| InChI | InChI=1S/C11H11NO2/c1-14-11(13)10(8-12)7-9-5-3-2-4-6-9/h2-6,10H,7H2,1H3 |
| InChIKey | LQAFHLCKDSSNNH-UHFFFAOYSA-N |
| Molecular Weight | 189.0787 |
| SMILES | c1(CC(C(OC)=O)C#N)ccccc1 |
| SPLASH | splash10-0006-9400000000-090a1b14d5ecf4c67fb8 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |