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methyl 3-(p-tert-butylphenylmercapto)propionate
SpectraBase Compound ID 6krYFDz5PT4
InChI InChI=1S/C14H20O2S/c1-14(2,3)11-5-7-12(8-6-11)17-10-9-13(15)16-4/h5-8H,9-10H2,1-4H3
InChIKey ZDVDVRLAVCQVKG-UHFFFAOYSA-N
Mol Weight 252.37 g/mol
Molecular Formula C14H20O2S
Exact Mass 252.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hu2Ag3vNejZ
Name methyl 3-(p-tert-butylphenylmercapto)propionate
Appearance Colorless transparent liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O2S
InChI InChI=1S/C14H20O2S/c1-14(2,3)11-5-7-12(8-6-11)17-10-9-13(15)16-4/h5-8H,9-10H2,1-4H3
InChIKey ZDVDVRLAVCQVKG-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 252.372 g/mol
SMILES c1c(ccc(c1)SCCC(OC)=O)C(C)(C)C
SPLASH splash10-000i-0490000000-b3b03ae30c7328253c55
Source of Spectrum CN103804249A
Thin-Layer Chromatography Rf = 0.46 (n-hexane/ethyl acetate, 4:1)
Wiley ID 1849688