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5-tert-Butyl-2-thiophenecarboxylic acid
SpectraBase Compound ID 4wqZqcGRq7W
InChI InChI=1S/C9H12O2S/c1-9(2,3)7-5-4-6(12-7)8(10)11/h4-5H,1-3H3,(H,10,11)
InChIKey BJDXNKJQTLSJPM-UHFFFAOYSA-N
Mol Weight 184.25 g/mol
Molecular Formula C9H12O2S
Exact Mass 184.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZPJYxTvA9s
Name 5-tert-Butyl-2-thiophenecarboxylic acid
CAS Registry Number 29212-25-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O2S
InChI InChI=1S/C9H12O2S/c1-9(2,3)7-5-4-6(12-7)8(10)11/h4-5H,1-3H3,(H,10,11)
InChIKey BJDXNKJQTLSJPM-UHFFFAOYSA-N
Molecular Weight 184.253 g/mol
SMILES OC(c1ccc(s1)C(C)(C)C)=O
SPLASH splash10-014i-3900000000-82208acf3b808c368708
Source of Spectrum JZ-1992-4310-0
Synonyms 2-Thiophenecarboxylic acid, 5-tert-butyl- 5-tert-Butyl-2-thenoic acid 5-tert-Butylthiophene-2-carboxylic acid
Wiley ID 157795