| SpectraBase Compound ID | 7BHC7oqIpYD |
|---|---|
| InChI | InChI=1S/C6H12O/c1-3-4-5-6(2)7/h3-5H2,1-2H3/i3D,4D2,5D2 |
| InChIKey | QQZOPKMRPOGIEB-CZMJLJOYSA-N |
| Mol Weight | 105.19 g/mol |
| Molecular Formula | C6H7D5O |
| Exact Mass | 105.120199 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6PvDL1MXpLm |
|---|---|
| Name | Methyl n-butyl ketone-D5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H7D5O |
| InChI | InChI=1S/C6H12O/c1-3-4-5-6(2)7/h3-5H2,1-2H3/i3D,4D2,5D2 |
| InChIKey | QQZOPKMRPOGIEB-CZMJLJOYSA-N |
| Molecular Weight | 105.192 g/mol |
| SMILES | C(=O)(C(C(C(C)[D])([D])[D])([D])[D])C |
| SPLASH | splash10-01ot-9000000000-88d763fe48dc09eb834d |
| Source of Spectrum | AJ-38-601-2 |
| Wiley ID | 1119599 |