| SpectraBase Compound ID | 9U316XR1VBj |
|---|---|
| InChI | InChI=1S/C8H16/c1-4-6-7-8(3)5-2/h3-7H2,1-2H3 |
| InChIKey | XTVRLCUJHGUXCP-UHFFFAOYSA-N |
| Mol Weight | 112.22 g/mol |
| Molecular Formula | C8H16 |
| Exact Mass | 112.125201 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | sVpp8T1FRM |
|---|---|
| Name | HEPTANE, 3-METHYLENE- |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C8H16 |
| InChI | InChI=1S/C8H16/c1-4-6-7-8(3)5-2/h3-7H2,1-2H3 |
| InChIKey | XTVRLCUJHGUXCP-UHFFFAOYSA-N |
| Molecular Weight | 112.1248 |
| SMILES | CCC(=C)CCCC |
| SPLASH | splash10-05bf-9000000000-2158c6451c51ec05e1a2 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |