| SpectraBase Spectrum ID |
FwtlnZdEeFh |
| Name |
1,cis-3,cis-4-Trimethylcyclohexane |
| CAS Registry Number |
4850-28-6 |
| Classification |
Intermediate fine chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
112.125200515 u |
| Formula |
C8H16 |
| InChI |
InChI=1S/C8H16/c1-6-4-7(2)8(3)5-6/h6-8H,4-5H2,1-3H3/t6-,7-,8+ |
| InChIKey |
PNUFYSGVPVMNRN-WHUPJOBBSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
112.216 g/mol |
| Nominal Mass |
112 u |
| Quality |
1000 |
| Retention Index |
813 |
| SMILES |
[C@@]1([C@@](C[C@](C1)(C)[H])(C)[H])(C)[H] |
| SPLASH |
splash10-05fr-9000000000-cc622fe1254d090d65ff |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1,cis-3,cis-4-Trimethylcyclopentane
(1S,2R)-1,2,4-Trimethylcyclopentane |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009785 |
