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1-Octanethiol

View entire compound with spectra: 9 NMR, 9 FTIR, 3 Raman, 12 MS (GC), and 2 Near IR

1-Octanethiol
SpectraBase Compound ID JyVYuNwwLvX
InChI InChI=1S/C8H18S/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3
InChIKey KZCOBXFFBQJQHH-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 49p2xcxwAsZ
Name 1-OCTANETHIOL
Copyright Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 146.112921754 u
Formula C8H18S
InChI InChI=1S/C8H18S/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3
InChIKey KZCOBXFFBQJQHH-UHFFFAOYSA-N
Molecular Weight 146.292 g/mol
Nominal Mass 146 u
Number of Peaks 66
SMILES CCCCCCCCS
SPLASH splash10-0ac4-9100000000-950128dc5fdc8090f31b
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX000969