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S-Phenyl phenylethanethioate
SpectraBase Compound ID D4GGlo1GMaF
InChI InChI=1S/C14H12OS/c15-14(11-12-7-3-1-4-8-12)16-13-9-5-2-6-10-13/h1-10H,11H2
InChIKey HULGOEHEUYXFID-UHFFFAOYSA-N
Mol Weight 228.31 g/mol
Molecular Formula C14H12OS
Exact Mass 228.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AEvy16dMeRr
Name S-Phenyl phenylethanethioate
Alternate Name(s) 2-Phenylethanethioic acid S-phenyl ester Benzeneethanethioic acid, S-phenyl ester Benzenethioacetic acid, S-phenyl ester S-phenyl 2-phenylethanethioate
CAS Registry Number 18245-74-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12OS
InChI InChI=1S/C14H12OS/c15-14(11-12-7-3-1-4-8-12)16-13-9-5-2-6-10-13/h1-10H,11H2
InChIKey HULGOEHEUYXFID-UHFFFAOYSA-N
Molecular Weight 228.309 g/mol
SMILES c1cc(ccc1)CC(=O)Sc1ccccc1
SPLASH splash10-00kf-9500000000-8086005df8777e50f6bf
Wiley ID 1488215