| SpectraBase Compound ID | Apbthg3OrHd |
|---|---|
| InChI | InChI=1S/C8H13NS/c1-3-4-5-8(6-9)7-10-2/h7H,3-5H2,1-2H3/b8-7- |
| InChIKey | CTKQYXRPNLBSGB-FPLPWBNLSA-N |
| Mol Weight | 155.26 g/mol |
| Molecular Formula | C8H13NS |
| Exact Mass | 155.076871 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BszNp8yis6X |
|---|---|
| Name | 2-Cyano-1-hexenyl methyl sulfide |
| Alternate Name(s) | (2Z)-2-butyl-3-(methylsulfanyl)-2-propenenitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H13NS |
| InChI | InChI=1S/C8H13NS/c1-3-4-5-8(6-9)7-10-2/h7H,3-5H2,1-2H3/b8-7- |
| InChIKey | CTKQYXRPNLBSGB-FPLPWBNLSA-N |
| Molecular Weight | 155.259 g/mol |
| SMILES | C(#N)\C(=C/SC)CCCC |
| SPLASH | splash10-03di-2900000000-fbe052d0778e295385c3 |
| Source of Spectrum | AJ-67-1496-3 |
| Wiley ID | 772610 |