| SpectraBase Spectrum ID |
5BZJ4oD0AS |
| Name |
(1S,2R,4R)-1,2,4-trimethylcyclohexane |
| CAS Registry Number |
7667-60-9 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
126.140850580 u |
| 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-/m0/s1 |
| InChIKey |
VCJPCEVERINRSG-YIZRAAEISA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
126.243 g/mol |
| Nominal Mass |
126 u |
| Quality |
987 |
| Retention Index |
914 |
| SMILES |
[C@@]1([C@@](CC[C@@](C1)(C)[H])(C)[H])(C)[H] |
| SPLASH |
splash10-07vl-9200000000-e78074bf9c785c123c15 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_034883 |
