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4-tert-Butylbenzenecarbothioic S-acid
SpectraBase Compound ID 48aF1EQFqLh
InChI InChI=1S/C11H14OS/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3,(H,12,13)
InChIKey AIHHGUYFEQQFOZ-UHFFFAOYSA-N
Mol Weight 194.29 g/mol
Molecular Formula C11H14OS
Exact Mass 194.076536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ICgwRVvFcQ
Name 4-tert-Butylbenzenecarbothioic S-acid
CAS Registry Number 72207-52-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14OS
InChI InChI=1S/C11H14OS/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3,(H,12,13)
InChIKey AIHHGUYFEQQFOZ-UHFFFAOYSA-N
Molecular Weight 194.292 g/mol
SMILES SC(c1ccc(cc1)C(C)(C)C)=O
SPLASH splash10-03di-6900000000-14629ea62111f40a347f
Source of Spectrum 0-16-99-1
Synonyms 4-tert-Butylthiobenzoic acid
Wiley ID 1190550