SpectraBase Compound ID | EYp1da5LOQN |
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InChI | InChI=1S/C7H12O2/c1-3-7(9)6(2)4-5-8/h5-6H,3-4H2,1-2H3 |
InChIKey | WPNJUNDOHHZWET-UHFFFAOYSA-N |
Mol Weight | 128.17 g/mol |
Molecular Formula | C7H12O2 |
Exact Mass | 128.08373 g/mol |
SpectraBase Spectrum ID | 78gSLc3AgUg |
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Name | 3-Methyl-4-oxohexanal |
Alternate Name(s) | 3-Methyl-4-oxo-hexanal 3-Methyl-4-oxidanylidene-hexanal |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C7H12O2 |
InChI | InChI=1S/C7H12O2/c1-3-7(9)6(2)4-5-8/h5-6H,3-4H2,1-2H3 |
InChIKey | WPNJUNDOHHZWET-UHFFFAOYSA-N |
Molecular Weight | 128.171 g/mol |
SMILES | C(=O)(C(CC=O)C)CC |
SPLASH | splash10-006t-9000000000-cb59aa7893942301172c |
Source of Spectrum | CRT-7-57-A |
Wiley ID | 1709450 |