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3-Phenylthiopivalophenone
SpectraBase Compound ID DEoNgx9aqfv
InChI InChI=1S/C17H18S/c1-17(2,13-14-9-5-3-6-10-14)16(18)15-11-7-4-8-12-15/h3-12H,13H2,1-2H3
InChIKey KPZUZFSQVMUJIY-UHFFFAOYSA-N
Mol Weight 254.39 g/mol
Molecular Formula C17H18S
Exact Mass 254.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 60yjW3SsWwa
Name 3-Phenylthiopivalophenone
Alternate Name(s) 2,2-Dimethyl-1,3-diphenyl-1-propanethione
CAS Registry Number 59530-92-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18S
InChI InChI=1S/C17H18S/c1-17(2,13-14-9-5-3-6-10-14)16(18)15-11-7-4-8-12-15/h3-12H,13H2,1-2H3
InChIKey KPZUZFSQVMUJIY-UHFFFAOYSA-N
Molecular Weight 254.391 g/mol
SMILES C(C(=S)c1ccccc1)(Cc1ccccc1)(C)C
SPLASH splash10-00dl-7940000000-43a689725c5980cd6e10
Source of Spectrum J-46-2015-0
Wiley ID 1258294