| SpectraBase Compound ID | 8O3cMDBiyjw |
|---|---|
| InChI | InChI=1S/C9H14/c1-5-8(3)7-9(4)6-2/h1,7,9H,6H2,2-4H3/b8-7-/t9-/m0/s1 |
| InChIKey | VZQPHBGNGCODSL-FUOZMLNRSA-N |
| Mol Weight | 122.21 g/mol |
| Molecular Formula | C9H14 |
| Exact Mass | 122.10955 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 90H3IUw7GQ2 |
|---|---|
| Name | 3,5-dimethyl-1-heptyn-3-ene isomer |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H14 |
| InChI | InChI=1S/C9H14/c1-5-8(3)7-9(4)6-2/h1,7,9H,6H2,2-4H3/b8-7-/t9-/m0/s1 |
| InChIKey | VZQPHBGNGCODSL-FUOZMLNRSA-N |
| Molecular Weight | 122.211 g/mol |
| SMILES | C(#C)\C(=C/[C@](CC)(C)[H])C |
| SPLASH | splash10-0a4i-0900000000-cd8d78fe17e07227aa5e |
| Source of Spectrum | SO-0-634-5 |
| Wiley ID | 1542383 |