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2,2-DIMETHYLPROPANTHIOL
SpectraBase Compound ID 547k44lLlEe
InChI InChI=1S/C5H12S/c1-5(2,3)4-6/h6H,4H2,1-3H3
InChIKey LSUXMVNABVPWMF-UHFFFAOYSA-N
Mol Weight 104.21 g/mol
Molecular Formula C5H12S
Exact Mass 104.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ExmilVOntMZ
Name 1-Propanethiol, 2,2-dimethyl-
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
Synonyms 2,2-Dimethyl-1-propanethiol 2,2-Dimethylpropane-1-thiol 2,2-Dimethylpropanethiol Neopentyl mercaptan EINECS 216-842-9
Wiley ID 144253