| SpectraBase Spectrum ID |
2kKmqr20PPE |
| Name |
Heptane,3-ethyl-2-methyl |
| CAS Registry Number |
14676-29-0 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
142.172150708 u |
| Formula |
C10H22 |
| InChI |
InChI=1S/C10H22/c1-5-7-8-10(6-2)9(3)4/h9-10H,5-8H2,1-4H3 |
| InChIKey |
NKMJCVVUYDKHAV-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
142.286 g/mol |
| Nominal Mass |
142 u |
| Quality |
986 |
| Retention Index |
984 |
| SMILES |
C(C(C)C)(CCCC)CC |
| SPLASH |
splash10-0a4l-9000000000-78f0e844528d92c83703 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-ethyl-2-methylheptane |
| Technique |
GC/MS |
| Wiley ID |
DD2024_034935 |
