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1-Hexanethiol

View entire compound with spectra: 5 NMR, 6 FTIR, 1 Raman, 9 MS (GC), and 2 Near IR

1-Hexanethiol
SpectraBase Compound ID DbPoddJKJSL
InChI InChI=1S/C6H14S/c1-2-3-4-5-6-7/h7H,2-6H2,1H3
InChIKey PMBXCGGQNSVESQ-UHFFFAOYSA-N
Mol Weight 118.24 g/mol
Molecular Formula C6H14S
Exact Mass 118.081622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Emt4l0ex0dG
Name 1-HEXANETHIOL
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 118.081621625 u
Formula C6H14S
InChI InChI=1S/C6H14S/c1-2-3-4-5-6-7/h7H,2-6H2,1H3
InChIKey PMBXCGGQNSVESQ-UHFFFAOYSA-N
Molecular Weight 118.238 g/mol
Nominal Mass 118 u
Number of Peaks 52
SMILES CCCCCCS
SPLASH splash10-052f-9000000000-819e40bd4a54ce5ea63d
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX000984