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3-Phenoxybenzylthiol
SpectraBase Compound ID 5eVeFurHgQ9
InChI InChI=1S/C13H12OS/c15-10-11-5-4-8-13(9-11)14-12-6-2-1-3-7-12/h1-9,15H,10H2
InChIKey BBYMAHJPOVVDMU-UHFFFAOYSA-N
Mol Weight 216.3 g/mol
Molecular Formula C13H12OS
Exact Mass 216.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LSXbC7xVLQJ
Name 3-Phenoxybenzylthiol
Appearance Oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12OS
InChI InChI=1S/C13H12OS/c15-10-11-5-4-8-13(9-11)14-12-6-2-1-3-7-12/h1-9,15H,10H2
InChIKey BBYMAHJPOVVDMU-UHFFFAOYSA-N
Instrument Name Agilent 6890-5973i
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.13.117
Molecular Weight 216.298 g/mol
Reported Formula C13H12OS
SMILES SCc1cc(ccc1)Oc1ccccc1
SPLASH splash10-00lr-2940000000-708869e0f2a2154de3b1
Source of Spectrum BJO-13-1187-15
Wiley ID 1848184