| SpectraBase Spectrum ID |
ExmilVOntMZ |
| Name |
1-Propanethiol, 2,2-dimethyl- |
| Alternate Name(s) |
2,2-Dimethyl-1-propanethiol
2,2-Dimethylpropane-1-thiol
2,2-Dimethylpropanethiol
Neopentyl mercaptan
EINECS 216-842-9 |
| CAS Registry Number |
1679-08-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C5H12S |
| InChI |
InChI=1S/C5H12S/c1-5(2,3)4-6/h6H,4H2,1-3H3 |
| InChIKey |
LSUXMVNABVPWMF-UHFFFAOYSA-N |
| Molecular Weight |
104.211 g/mol |
| SMILES |
SCC(C)(C)C |
| SPLASH |
splash10-0a4i-9000000000-52f45d39fbf411d24a0e |
| Source of Spectrum |
AA-0-305-1 |
| Wiley ID |
144253 |
