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2-(2-(Methylthio)ethyl)phenol
SpectraBase Compound ID A8K7l1MFkY8
InChI InChI=1S/C9H12OS/c1-11-7-6-8-4-2-3-5-9(8)10/h2-5,10H,6-7H2,1H3
InChIKey FHSAFXBXTZMJPI-UHFFFAOYSA-N
Mol Weight 168.25 g/mol
Molecular Formula C9H12OS
Exact Mass 168.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3tXCbvhi7A
Name 2-(2-(Methylthio)ethyl)phenol
Appearance Pale-yellow oil
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 168.060886179 u
Formula C9H12OS
GC Oven Program Oven temp 300oC
InChI InChI=1S/C9H12OS/c1-11-7-6-8-4-2-3-5-9(8)10/h2-5,10H,6-7H2,1H3
InChIKey FHSAFXBXTZMJPI-UHFFFAOYSA-N
Inlet Type Split
Instrument Name Agilent Technologies 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202101278
Molecular Weight 168.254 g/mol
Quality 87
SMILES OC1=C(CCSC)C=CC=C1
SPLASH splash10-0a4i-0900000000-1ca0d64e31a35271d1aa
Source of Spectrum K1-2022-SM14-11 (DOI: 10.1002/ejoc.202101278)
Thin-Layer Chromatography 0.17 (cyclohexane/EtOAc, 10:1)
Wiley ID 1898536