| SpectraBase Compound ID | HsF2jsPzrVg |
|---|---|
| InChI | InChI=1S/C8H9NS/c1-3-5-6-8(4-2)9-7-10/h2-3,8H,1,5-6H2 |
| InChIKey | HDOCPAOJZVLPBX-UHFFFAOYSA-N |
| Mol Weight | 151.23 g/mol |
| Molecular Formula | C8H9NS |
| Exact Mass | 151.04557 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | rw5C9Bmt2X |
|---|---|
| Name | 5-(Isothiocyanato)hept-1-en-6-yne |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H9NS |
| InChI | InChI=1S/C8H9NS/c1-3-5-6-8(4-2)9-7-10/h2-3,8H,1,5-6H2 |
| InChIKey | HDOCPAOJZVLPBX-UHFFFAOYSA-N |
| Molecular Weight | 151.227 g/mol |
| SMILES | C(N=C=S)(C#C)CCC=C |
| SPLASH | splash10-000f-9000000000-120d7b0a157721f08bb0 |
| Source of Spectrum | K1-2001-1096-3 |
| Synonyms | 5-isothiocyanato-1-hepten-6-yne |
| Wiley ID | 846799 |