| SpectraBase Compound ID | iCPAjQ9Ban |
|---|---|
| InChI | InChI=1S/C7H11NO2/c1-2-3-6(8)4-5-7(9)10/h3,6H,1,4-5,8H2,(H,9,10) |
| InChIKey | XWILORJMRMFKPM-UHFFFAOYSA-N |
| Mol Weight | 141.17 g/mol |
| Molecular Formula | C7H11NO2 |
| Exact Mass | 141.078979 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 676SWq2T8sa |
|---|---|
| Name | 4-Amino-5,6-heptadienoic acid |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C7H11NO2 |
| InChI | InChI=1S/C7H11NO2/c1-2-3-6(8)4-5-7(9)10/h3,6H,1,4-5,8H2,(H,9,10) |
| InChIKey | XWILORJMRMFKPM-UHFFFAOYSA-N |
| Literature Reference | A.L. Castelhano, A. Krantz, J. Am. Chem. Soc. 106, 1877 (1984). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |