| SpectraBase Spectrum ID |
8GloSmg4d3g |
| Name |
2,2-Dimethylpentane |
| CAS Registry Number |
590-35-2 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
100.125200515 u |
| Formula |
C7H16 |
| InChI |
InChI=1S/C7H16/c1-5-6-7(2,3)4/h5-6H2,1-4H3 |
| InChIKey |
CXOWYJMDMMMMJO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
100.205 g/mol |
| Nominal Mass |
100 u |
| Quality |
998 |
| Retention Index |
684 |
| SMILES |
C(C(C)(C)C)CC |
| SPLASH |
splash10-052f-9000000000-d1e2a59776dc4e8d1e0c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2,2-dimethylpentane |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007638 |
