| SpectraBase Compound ID | 9uZAZFzWuVa |
|---|---|
| InChI | InChI=1S/C8H12S/c1-2-3-4-8-5-6-9-7-8/h5-7H,2-4H2,1H3/i5D,6D,7D |
| InChIKey | KPOCSQCZXMATFR-CRSPMMAGSA-N |
| Mol Weight | 143.26 g/mol |
| Molecular Formula | C8H9D3S |
| Exact Mass | 143.084802 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | nloI6bkOgY |
|---|---|
| Name | 2,4,5-trideutero-3-n-butylthiophene |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H9D3S |
| InChI | InChI=1S/C8H12S/c1-2-3-4-8-5-6-9-7-8/h5-7H,2-4H2,1H3/i5D,6D,7D |
| InChIKey | KPOCSQCZXMATFR-CRSPMMAGSA-N |
| Molecular Weight | 143.262 g/mol |
| SMILES | c1(sc(c(c1CCCC)[D])[D])[D] |
| SPLASH | splash10-0udi-2900000000-675a4606a39a64dd6ed9 |
| Source of Spectrum | O-29-432-0 |
| Wiley ID | 1139526 |