| SpectraBase Compound ID | 94sOrbJ9fyv |
|---|---|
| InChI | InChI=1S/C12H16/c1-11(2)9-7-5-6-8-10-12(3)4/h5-6,11-12H,1-4H3/b6-5+ |
| InChIKey | ILORPCKQIVJVIE-AATRIKPKSA-N |
| Mol Weight | 160.26 g/mol |
| Molecular Formula | C12H16 |
| Exact Mass | 160.125201 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Fpwsh4BcwVU |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H16 |
| InChI | InChI=1S/C12H16/c1-11(2)9-7-5-6-8-10-12(3)4/h5-6,11-12H,1-4H3/b6-5+ |
| InChIKey | ILORPCKQIVJVIE-AATRIKPKSA-N |
| Molecular Weight | 160.1248 |
| SMILES | CC(C#C\C=C\C#CC(C)C)C |
| SPLASH | splash10-02wc-7900000000-72155573f0c3ecf1f7df |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |