| SpectraBase Compound ID | BMJ6Ljlwgp4 |
|---|---|
| InChI | InChI=1S/C8H14/c1-3-5-7-8-6-4-2/h1H,4-8H2,2H3/i1+1 |
| InChIKey | UMIPWJGWASORKV-OUBTZVSYSA-N |
| Mol Weight | 111.19 g/mol |
| Molecular Formula | C713CH14 |
| Exact Mass | 111.112905 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4sjhuzxrb5n |
|---|---|
| Name | 1-Octyne-1-13C |
| Comments | Original formula: C7[13C]H14 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H14 |
| InChI | InChI=1S/C8H14/c1-3-5-7-8-6-4-2/h1H,4-8H2,2H3/i1+1 |
| InChIKey | UMIPWJGWASORKV-OUBTZVSYSA-N |
| Molecular Weight | 111.192 g/mol |
| SMILES | [13CH]#CCCCCCC |
| SPLASH | splash10-052f-9000000000-871e7d84b61abaeb41b9 |
| Source of Spectrum | H-66-330-0 |
| Wiley ID | 1122570 |