| SpectraBase Compound ID | H4WWD0sDpQu |
|---|---|
| InChI | InChI=1S/C8H9NO2/c1-2-11-8(10)7-4-3-5-9-6-7/h3-6H,2H2,1H3/i1D3,2D2 |
| InChIKey | XBLVHTDFJBKJLG-ZBJDZAJPSA-N |
| Mol Weight | 156.2 g/mol |
| Molecular Formula | C8H4D5NO2 |
| Exact Mass | 156.094712 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JHfMDagcPkP |
|---|---|
| Name | Nicotinic acid,pentadeuteroethyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H4D5NO2 |
| InChI | InChI=1S/C8H9NO2/c1-2-11-8(10)7-4-3-5-9-6-7/h3-6H,2H2,1H3/i1D3,2D2 |
| InChIKey | XBLVHTDFJBKJLG-ZBJDZAJPSA-N |
| Molecular Weight | 156.196 g/mol |
| SMILES | C(c1cnccc1)(=O)OC(C([D])([D])[D])([D])[D] |
| SPLASH | splash10-0a4i-0900000000-f602a108cb902d378fe5 |
| Source of Spectrum | N2-1973-41-0 |
| Wiley ID | 1148200 |