| SpectraBase Compound ID | C4yrxvcdTD3 |
|---|---|
| InChI | InChI=1S/C6H10S/c1-2-4-6-7-5-3-1/h3,5H,1-2,4,6H2 |
| InChIKey | VRKPANGTGANDRQ-UHFFFAOYSA-N |
| Mol Weight | 114.21 g/mol |
| Molecular Formula | C6H10S |
| Exact Mass | 114.050321 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BHQKfMUvBhd |
|---|---|
| Name | 2,3,4,5-Tetrahydrothiepin |
| CAS Registry Number | 77566-13-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H10S |
| InChI | InChI=1S/C6H10S/c1-2-4-6-7-5-3-1/h3,5H,1-2,4,6H2 |
| InChIKey | VRKPANGTGANDRQ-UHFFFAOYSA-N |
| Molecular Weight | 114.206 g/mol |
| SMILES | C=1SCCCCC1 |
| SPLASH | splash10-01p2-9200000000-87fce0d165257b951530 |
| Source of Spectrum | AC-1980-371-0 |
| Synonyms | 2,3,4,5-Tetrahydrothiepine |
| Wiley ID | 1124492 |