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4-tert-BUTYL-o-TOLUENETHIOL
SpectraBase Compound ID HqzivOv6LuQ
InChI InChI=1S/C11H16S/c1-8-7-9(11(2,3)4)5-6-10(8)12/h5-7,12H,1-4H3
InChIKey DUZJXKYBSMFDIU-UHFFFAOYSA-N
Mol Weight 180.31 g/mol
Molecular Formula C11H16S
Exact Mass 180.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3e1MbZT1kRY
Name Benzenethiol, 4-(1,1-dimethylethyl)-2-methyl-
CAS Registry Number 15570-10-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16S
InChI InChI=1S/C11H16S/c1-8-7-9(11(2,3)4)5-6-10(8)12/h5-7,12H,1-4H3
InChIKey DUZJXKYBSMFDIU-UHFFFAOYSA-N
Molecular Weight 180.309 g/mol
SMILES Sc1c(cc(C(C)(C)C)cc1)C
SPLASH splash10-014i-3900000000-0f5a703b23f626b7805f
Source of Spectrum T-66-951-0
Synonyms 4-tert-Butyl-2-methylbenzenethiol 4-tert-Butyl-2-methylthiophenol 4-tert-Butyl-o-Thiocresol o-Toluenethiol, 4-tert-butyl-
Wiley ID 18219