| SpectraBase Compound ID | LJssFFDnZDo |
|---|---|
| InChI | InChI=1S/C8H18/c1-4-6-7-8(3)5-2/h8H,4-7H2,1-3H3 |
| InChIKey | LAIUFBWHERIJIH-UHFFFAOYSA-N |
| Mol Weight | 114.23 g/mol |
| Molecular Formula | C8H18 |
| Exact Mass | 114.140851 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2o20OPO774p |
|---|---|
| Name | HEPTANE, 3-METHYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H18 |
| InChI | InChI=1S/C8H18/c1-4-6-7-8(3)5-2/h8H,4-7H2,1-3H3 |
| InChIKey | LAIUFBWHERIJIH-UHFFFAOYSA-N |
| Instrument Name | CH4 |
| Molecular Weight | 114.1404 |
| SMILES | CCC(CCCC)C |
| SPLASH | splash10-052f-9000000000-8bf70c1903769ac1ea26 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |