| SpectraBase Compound ID | BZbvuGNBYVA |
|---|---|
| InChI | InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6,12H,5,7-9H2,1-4H3/i2D3,7D2 |
| InChIKey | JHJCHCSUEGPIGE-RCIWAKOPSA-N |
| Mol Weight | 199.35 g/mol |
| Molecular Formula | C13H172D5O |
| Exact Mass | 199.198449 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | G4seUPVFa85 |
|---|---|
| Name | 2-Butanone-1,1,1,3,3-D5, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)- |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H17D5O |
| InChI | InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6,12H,5,7-9H2,1-4H3/i2D3,7D2 |
| InChIKey | JHJCHCSUEGPIGE-RCIWAKOPSA-N |
| Molecular Weight | 199.349 g/mol |
| SMILES | C(C(CC1C(=CCCC1(C)C)C)([D])[D])(C([D])([D])[D])=O |
| SPLASH | splash10-00dm-9800000000-ce5aa5ef1555e2a1e2f7 |
| Wiley ID | 1483204 |