| SpectraBase Compound ID | 5jbUE3pV5z0 |
|---|---|
| InChI | InChI=1S/C7H14/c1-7-5-3-2-4-6-7/h7H,2-6H2,1H3/i3D/t3-,7-/m1/s1 |
| InChIKey | UAEPNZWRGJTJPN-BVGWGMFRSA-N |
| Mol Weight | 99.2 g/mol |
| Molecular Formula | C7H13D |
| Exact Mass | 99.115827 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | E4wGjXS8F7i |
|---|---|
| Name | (1S,3R)-3-Methyl(1-d)cyclohexane |
| CAS Registry Number | 66529-35-9 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H13D |
| InChI | InChI=1S/C7H14/c1-7-5-3-2-4-6-7/h7H,2-6H2,1H3/i3D/t3-,7-/m1/s1 |
| InChIKey | UAEPNZWRGJTJPN-BVGWGMFRSA-N |
| Molecular Weight | 99.195 g/mol |
| SMILES | [C@@]1(C)(CCC[C@](C1)([D])[H])[H] |
| SPLASH | splash10-053r-9000000000-a419dcd552f354d148f8 |
| Source of Spectrum | J-45-5235-0 |
| Wiley ID | 1119034 |