| SpectraBase Compound ID | 5PcdDlfmSCa |
|---|---|
| InChI | InChI=1S/C7H12/c1-4-5-6-7(2)3/h1,7H,5-6H2,2-3H3 |
| InChIKey | HKNANEMUCJGPMS-UHFFFAOYSA-N |
| Mol Weight | 96.17 g/mol |
| Molecular Formula | C7H12 |
| Exact Mass | 96.0939 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GwIN37ygPqC |
|---|---|
| Name | 5-METHYL-1-HEXYNE |
| Source of Sample | Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan |
| Boiling Point | 91C |
| CAS Registry Number | 2203-80-7 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12 |
| InChI | InChI=1S/C7H12/c1-4-5-6-7(2)3/h1,7H,5-6H2,2-3H3 |
| InChIKey | HKNANEMUCJGPMS-UHFFFAOYSA-N |
| Molecular Weight | 96.17 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300 |
| Synonyms | 1-HEXYNE, 5-METHYL-, 1-HEXYNE, 5-METHYL-, |