SpectraBase Compound ID | 5kuaddrtE2P |
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InChI | InChI=1S/C8H14/c1-7(2)5-6-8(3)4/h6H,1,5H2,2-4H3/i3D,5D/b8-6- |
InChIKey | JRFKHZNULLDOGQ-PYAWVNOPSA-N |
Mol Weight | 112.21 g/mol |
Molecular Formula | C8H12D2 |
Exact Mass | 112.122104 g/mol |
SpectraBase Spectrum ID | 9goVZYUQ44l |
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Name | (3,1'-Dideuterio)-2,5-dimethyl-1,4-hexadiene |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H12D2 |
InChI | InChI=1S/C8H14/c1-7(2)5-6-8(3)4/h6H,1,5H2,2-4H3/i3D,5D/b8-6- |
InChIKey | JRFKHZNULLDOGQ-PYAWVNOPSA-N |
Molecular Weight | 112.212 g/mol |
SMILES | C\C(=C/C(C(=C)C)[D])C[D] |
SPLASH | splash10-0002-9200000000-a9bb22004325d29de7ea |
Source of Spectrum | U1-1998-797-17 |
Wiley ID | 751060 |