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Biphenyl-4-ylmethanethiol

View entire compound with spectra: 1 MS (GC)

Biphenyl-4-ylmethanethiol
SpectraBase Compound ID J1QxXsZJb3P
InChI InChI=1S/C13H12S/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,14H,10H2
InChIKey PFMNHBLMRAOCSB-UHFFFAOYSA-N
Mol Weight 200.3 g/mol
Molecular Formula C13H12S
Exact Mass 200.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DF8nAdgTUi6
Name Biphenyl-4-ylmethanethiol
Alternate Name(s) [1,1'-biphenyl]-4-ylmethanethiol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12S
InChI InChI=1S/C13H12S/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,14H,10H2
InChIKey PFMNHBLMRAOCSB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cbdv.201100124
Molecular Weight 200.299 g/mol
SMILES SCc1ccc(cc1)-c1ccccc1
SPLASH splash10-014i-0910000000-f86dc6cabd2d27bfba9f
Source of Spectrum CBD-9-724-7
Wiley ID 1771145