| SpectraBase Spectrum ID |
Fpswe3k3g38 |
| Name |
3-pyridylmethyl 8,8,8-trideuteriooctanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18D3NO2 |
| InChI |
InChI=1S/C14H21NO2/c1-2-3-4-5-6-9-14(16)17-12-13-8-7-10-15-11-13/h7-8,10-11H,2-6,9,12H2,1H3/i1D3 |
| InChIKey |
KFPOCDRTBYFTBE-FIBGUPNXSA-N |
| Instrument Name |
HP 6890-5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1016/j.jasms.2006.07.004 |
| Molecular Weight |
238.345 g/mol |
| SMILES |
C(CCC(OCc1cnccc1)=O)CCCC([D])([D])[D] |
| SPLASH |
splash10-052f-7900000000-8eb44156fca36883a410 |
| Source of Spectrum |
A7-17-1623-Fig 3 |
| Wiley ID |
1857471 |
