| SpectraBase Compound ID | IXniYcGaQ0j |
|---|---|
| InChI | InChI=1S/C5H9NS/c1-2-3-4-5(6)7/h2-3H,4H2,1H3,(H2,6,7)/b3-2+ |
| InChIKey | VHGJTBXIGLAUSJ-NSCUHMNNSA-N |
| Mol Weight | 115.19 g/mol |
| Molecular Formula | C5H9NS |
| Exact Mass | 115.04557 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | I2mWixm4wB4 |
|---|---|
| Name | Pent-3-enethioic acid amide |
| Alternate Name(s) | (E)-3-pentenethioamide |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H9NS |
| InChI | InChI=1S/C5H9NS/c1-2-3-4-5(6)7/h2-3H,4H2,1H3,(H2,6,7)/b3-2+ |
| InChIKey | VHGJTBXIGLAUSJ-NSCUHMNNSA-N |
| Molecular Weight | 115.194 g/mol |
| SMILES | NC(=S)C\C=C\C |
| SPLASH | splash10-014i-0900000000-47fbc5c990376f7ab0f1 |
| Source of Spectrum | F4-40-4016-21 |
| Wiley ID | 1671463 |