| SpectraBase Compound ID | D2HPoowKPIN |
|---|---|
| InChI | InChI=1S/C9H20S/c1-8(5-6-10)7-9(2,3)4/h8,10H,5-7H2,1-4H3 |
| InChIKey | YZWVPNPGWMPZKQ-UHFFFAOYSA-N |
| Mol Weight | 160.32 g/mol |
| Molecular Formula | C9H20S |
| Exact Mass | 160.128572 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FE40Xsm3zaQ |
|---|---|
| Name | 3,5,5-trimethyl-1-hexanethiol |
| Alternate Name(s) | 3,5,5-trimethylhexane-1-thiol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H20S |
| InChI | InChI=1S/C9H20S/c1-8(5-6-10)7-9(2,3)4/h8,10H,5-7H2,1-4H3 |
| InChIKey | YZWVPNPGWMPZKQ-UHFFFAOYSA-N |
| Molecular Weight | 160.319 g/mol |
| SMILES | SCCC(CC(C)(C)C)C |
| SPLASH | splash10-0a4i-9100000000-e4621da656764fb3614c |
| Source of Spectrum | IC-287-0-0 |
| Wiley ID | 1156974 |