SpectraBase Compound ID | GoVLXX2YHEw |
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InChI | InChI=1S/C8H12S/c1-2-3-4-8-5-6-9-7-8/h5-7H,2-4H2,1H3/i3D2 |
InChIKey | KPOCSQCZXMATFR-SMZGMGDZSA-N |
Mol Weight | 142.26 g/mol |
Molecular Formula | C8H10D2S |
Exact Mass | 142.078525 g/mol |
SpectraBase Spectrum ID | 3nwfg20bjBp |
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Name | 3-(2,2-dideutero-n-butyl)thiophene |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H10D2S |
InChI | InChI=1S/C8H12S/c1-2-3-4-8-5-6-9-7-8/h5-7H,2-4H2,1H3/i3D2 |
InChIKey | KPOCSQCZXMATFR-SMZGMGDZSA-N |
Molecular Weight | 142.256 g/mol |
SMILES | c1sccc1CC(CC)([D])[D] |
SPLASH | splash10-0002-9000000000-988ee6145a542420bcd0 |
Source of Spectrum | O-29-432-0 |
Wiley ID | 1139524 |