| SpectraBase Compound ID | 8Gq8yCFoSHT |
|---|---|
| InChI | InChI=1S/C7H14O/c1-6(2)4-5-7(3)8/h6H,4-5H2,1-3H3/i6D |
| InChIKey | FFWSICBKRCICMR-RAMDWTOOSA-N |
| Mol Weight | 115.19 g/mol |
| Molecular Formula | C7H13DO |
| Exact Mass | 115.110742 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2nz4jt76hd9 |
|---|---|
| Name | 5-Methyl-2-hexanone-5-D1 |
| CAS Registry Number | 29366-29-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H13DO |
| InChI | InChI=1S/C7H14O/c1-6(2)4-5-7(3)8/h6H,4-5H2,1-3H3/i6D |
| InChIKey | FFWSICBKRCICMR-RAMDWTOOSA-N |
| Molecular Weight | 115.194 g/mol |
| SMILES | C(=O)(CCC(C)(C)[D])C |
| SPLASH | splash10-052f-9000000000-1ce93d0525a5449d0e86 |
| Source of Spectrum | C-92-3086-3 |
| Wiley ID | 3255 |