| SpectraBase Compound ID | K0oE8epP25j |
|---|---|
| InChI | InChI=1S/C9H8/c1-3-9-7-5-4-6-8(9)2/h1,4-7H,2H3 |
| InChIKey | MYBSUWNEMXUTAX-UHFFFAOYSA-N |
| Mol Weight | 116.16 g/mol |
| Molecular Formula | C9H8 |
| Exact Mass | 116.0626 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5Nt6kreBWSu |
|---|---|
| Name | 1-Ethynyl-2-methyl-benzene |
| CAS Registry Number | 766-47-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H8 |
| InChI | InChI=1S/C9H8/c1-3-9-7-5-4-6-8(9)2/h1,4-7H,2H3 |
| InChIKey | MYBSUWNEMXUTAX-UHFFFAOYSA-N |
| Molecular Weight | 116.163 g/mol |
| SMILES | c1(c(cccc1)C)C#C |
| SPLASH | splash10-014i-4900000000-bef1797cd9cdaf88d025 |
| Source of Spectrum | KC-0-1731-7 |
| Synonyms | 2-Methylphenylacetylene Benzene,1-ethynyl-2-methyl- |
| Wiley ID | 781430 |