| SpectraBase Compound ID | B1vJPm1XO9y |
|---|---|
| InChI | InChI=1S/C9H18/c1-7-4-5-8(2)9(3)6-7/h7-9H,4-6H2,1-3H3/t7-,8+,9+/m1/s1 |
| InChIKey | VCJPCEVERINRSG-VGMNWLOBSA-N |
| Mol Weight | 126.24 g/mol |
| Molecular Formula | C9H18 |
| Exact Mass | 126.140851 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FLL2FW0j2GQ |
|---|---|
| Name | (1S,2S,4R)-1,2,4-trimethylcyclohexane |
| CAS Registry Number | 7667-59-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H18 |
| InChI | InChI=1S/C9H18/c1-7-4-5-8(2)9(3)6-7/h7-9H,4-6H2,1-3H3/t7-,8+,9+/m1/s1 |
| InChIKey | VCJPCEVERINRSG-VGMNWLOBSA-N |
| Molecular Weight | 126.243 g/mol |
| SMILES | [C@]1(C[C@](C)(CC[C@@]1(C)[H])[H])(C)[H] |
| SPLASH | splash10-0929-9700000000-56024486b55edd25696b |
| Source of Spectrum | O-20-87-6 |
| Wiley ID | 1130468 |