| SpectraBase Compound ID | JXG7bXGVnGp |
|---|---|
| InChI | InChI=1S/C9H16/c1-4-6-7-8-9(3)5-2/h9H,4-5,8H2,1-3H3 |
| InChIKey | LDZYCPWLKDNBLI-UHFFFAOYSA-N |
| Mol Weight | 124.23 g/mol |
| Molecular Formula | C9H16 |
| Exact Mass | 124.125201 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | J99c3pENlmZ |
|---|---|
| Name | 3-OCTYNE, 6-METHYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H16 |
| InChI | InChI=1S/C9H16/c1-4-6-7-8-9(3)5-2/h9H,4-5,8H2,1-3H3 |
| InChIKey | LDZYCPWLKDNBLI-UHFFFAOYSA-N |
| Instrument Name | CH4 |
| Molecular Weight | 124.1248 |
| SMILES | CCC#CCC(CC)C |
| SPLASH | splash10-0ar3-9000000000-eead4fe5c348990e253c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |