SpectraBase Compound ID | AfT3akWziUp |
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InChI | InChI=1S/C8H14O/c1-4-6-8(9)7(3)5-2/h4,6-7H,5H2,1-3H3/b6-4+/t7-/m0/s1 |
InChIKey | ARJWAURHQDJJAC-KNIZRNDPSA-N |
Mol Weight | 126.2 g/mol |
Molecular Formula | C8H14O |
Exact Mass | 126.104465 g/mol |
SpectraBase Spectrum ID | JzKdXHgCU0K |
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Name | (E,5S)-5-methyl-2-hepten-4-one |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H14O |
InChI | InChI=1S/C8H14O/c1-4-6-8(9)7(3)5-2/h4,6-7H,5H2,1-3H3/b6-4+/t7-/m0/s1 |
InChIKey | ARJWAURHQDJJAC-KNIZRNDPSA-N |
Molecular Weight | 126.199 g/mol |
SMILES | C(\C=C\C)(=O)[C@](CC)(C)[H] |
SPLASH | splash10-014i-9000000000-0196fde40f37b72f506a |
Source of Spectrum | F-55-9791-8 |
Synonyms | (E,5S)-5-methylhept-2-en-4-one |
Wiley ID | 838799 |