| SpectraBase Compound ID | 4579B76k6B2 |
|---|---|
| InChI | InChI=1S/C5H4N2S/c6-4-8-5-2-1-3-7-5/h1-3,7H |
| InChIKey | HFULIPRJFZSFOB-UHFFFAOYSA-N |
| Mol Weight | 124.16 g/mol |
| Molecular Formula | C5H4N2S |
| Exact Mass | 124.009519 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5hJKdMF6NtO |
|---|---|
| Name | 1H-pyrrol-2-yl thiocyanate |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H4N2S |
| InChI | InChI=1S/C5H4N2S/c6-4-8-5-2-1-3-7-5/h1-3,7H |
| InChIKey | HFULIPRJFZSFOB-UHFFFAOYSA-N |
| Molecular Weight | 124.161 g/mol |
| SMILES | [nH]1cccc1SC#N |
| SPLASH | splash10-00di-0900000000-44bc113fb6c03e4d221a |
| Source of Spectrum | I-85-936-2 |
| Synonyms | thiocyanic acid 1H-pyrrol-2-yl ester |
| Wiley ID | 1584927 |