| SpectraBase Spectrum ID |
4Q77TCR7lwf |
| Name |
1-trans-2-cis-3-trans-trimethylcyclopentane |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
112.125200515 u |
| Formula |
C8H16 |
| InChI |
InChI=1S/C8H16/c1-6-4-5-7(2)8(6)3/h6-8H,4-5H2,1-3H3/t6-,7+,8+ |
| InChIKey |
VCWNHOPGKQCXIQ-JIGDXULJSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
112.216 g/mol |
| Nominal Mass |
112 u |
| Quality |
998 |
| Retention Index |
813 |
| SMILES |
[C@]1([C@@](CC[C@@]1(C)[H])(C)[H])(C)[H] |
| SPLASH |
splash10-0a4i-9000000000-b675b4eb02da00a86e00 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(1R,3S)-1,2,3-trimethylcyclopentane |
| Technique |
GC/MS |
| Wiley ID |
DD2024_035066 |
