| SpectraBase Compound ID | A5tuDNIljUS |
|---|---|
| InChI | InChI=1S/C6H12OS/c7-6-3-1-2-4-8-5-6/h6-7H,1-5H2 |
| InChIKey | LCVICOLXCLJYIQ-UHFFFAOYSA-N |
| Mol Weight | 132.22 g/mol |
| Molecular Formula | C6H12OS |
| Exact Mass | 132.060886 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B190FAyFW76 |
|---|---|
| Name | 3-Thiepanol |
| Alternate Name(s) | Thiacycloheptane-3-ol thiepan-3-ol |
| CAS Registry Number | 18643-30-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H12OS |
| InChI | InChI=1S/C6H12OS/c7-6-3-1-2-4-8-5-6/h6-7H,1-5H2 |
| InChIKey | LCVICOLXCLJYIQ-UHFFFAOYSA-N |
| Molecular Weight | 132.221 g/mol |
| SMILES | OC1CSCCCC1 |
| SPLASH | splash10-0a4l-9100000000-344e1a53174b86f553e3 |
| Source of Spectrum | O-15-380-1 |
| Wiley ID | 1133687 |