| SpectraBase Compound ID | G4f6eJRBUms |
|---|---|
| InChI | InChI=1S/C13H16/c1-3-4-5-6-9-13-10-7-8-12(2)11-13/h7-8,10-11H,3-5H2,1-2H3 |
| InChIKey | ADEGKMCLJHMUAM-UHFFFAOYSA-N |
| Mol Weight | 172.27 g/mol |
| Molecular Formula | C13H16 |
| Exact Mass | 172.125201 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B2BR4d3QMAy |
|---|---|
| Name | 1-(3-Methylphenyl)hex-1-yne |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H16 |
| InChI | InChI=1S/C13H16/c1-3-4-5-6-9-13-10-7-8-12(2)11-13/h7-8,10-11H,3-5H2,1-2H3 |
| InChIKey | ADEGKMCLJHMUAM-UHFFFAOYSA-N |
| Molecular Weight | 172.271 g/mol |
| SMILES | C(#CCCCC)c1cc(C)ccc1 |
| SPLASH | splash10-056u-0900000000-9b94165759e27cb1d33b |
| Source of Spectrum | F-66-7759-19 |
| Synonyms | 1-Hex-1-ynyl-3-methylbenzene |
| Wiley ID | 1684525 |