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2-Heptanethiol, 2-methyl-
SpectraBase Compound ID JAovxXqMQGV
InChI InChI=1S/C8H18S/c1-4-5-6-7-8(2,3)9/h9H,4-7H2,1-3H3
InChIKey KSTAKRCVPORMCA-UHFFFAOYSA-N
Mol Weight 146.29 g/mol
Molecular Formula C8H18S
Exact Mass 146.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9T7YqVjgg0A
Name 2-Heptanethiol, 2-methyl-
CAS Registry Number 763-20-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H18S
InChI InChI=1S/C8H18S/c1-4-5-6-7-8(2,3)9/h9H,4-7H2,1-3H3
InChIKey KSTAKRCVPORMCA-UHFFFAOYSA-N
Molecular Weight 146.292 g/mol
SMILES SC(C)(C)CCCCC
SPLASH splash10-0a4i-9000000000-31a5a967a842a6b9cc32
Source of Spectrum AA-0-838-4
Synonyms 1,1-Dimethylhexyl hydrosulfide 2-Methyl-2-heptanethiol 2-Methyl-2-heptylmercaptan 2-Methylheptane-2-thiol
Wiley ID 9207