| SpectraBase Compound ID | EmxPRkapkj9 |
|---|---|
| InChI | InChI=1S/C8H12/c1-4-5-6-7-8(2)3/h1,7H,5-6H2,2-3H3 |
| InChIKey | UDNVVNDNOWKDGK-UHFFFAOYSA-N |
| Mol Weight | 108.18 g/mol |
| Molecular Formula | C8H12 |
| Exact Mass | 108.0939 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1OIfVSXA2BO |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H12 |
| InChI | InChI=1S/C8H12/c1-4-5-6-7-8(2)3/h1,7H,5-6H2,2-3H3 |
| InChIKey | UDNVVNDNOWKDGK-UHFFFAOYSA-N |
| Molecular Weight | 108.0936 |
| SMILES | CC(=CCCC#C)C |
| SPLASH | splash10-0006-9100000000-e099bff882b636a114a6 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |