| SpectraBase Compound ID | 8stzujSZAQu |
|---|---|
| InChI | InChI=1S/C7H11NO2/c1-10-7(9)5-3-2-4-6-8/h2-5H2,1H3 |
| InChIKey | FLUGZEGZYQCCTQ-UHFFFAOYSA-N |
| Mol Weight | 141.17 g/mol |
| Molecular Formula | C7H11NO2 |
| Exact Mass | 141.078979 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BYPgA4oNii2 |
|---|---|
| Name | PENTANOIC ACID, 5-CYANO-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H11NO2 |
| InChI | InChI=1S/C7H11NO2/c1-10-7(9)5-3-2-4-6-8/h2-5H2,1H3 |
| InChIKey | FLUGZEGZYQCCTQ-UHFFFAOYSA-N |
| Instrument Name | CH7 |
| Molecular Weight | 141.0787 |
| SMILES | C(#N)CCCCC(OC)=O |
| SPLASH | splash10-0c0u-9100000000-79b98832e5c90808c341 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |