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2-(T-Butylaminocarbonyl)-3-thiophenecarboxylic acid
SpectraBase Compound ID ANpf8GOJKMz
InChI InChI=1S/C10H13NO3S/c1-10(2,3)11-8(12)7-6(9(13)14)4-5-15-7/h4-5H,1-3H3,(H,11,12)(H,13,14)
InChIKey QUZTWSMTEVXSPF-UHFFFAOYSA-N
Mol Weight 227.28 g/mol
Molecular Formula C10H13NO3S
Exact Mass 227.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FxJYTuqZUbC
Name 2-(tert-butylcarbamoyl)-3-thenoic acid
CAS Registry Number 98331-03-4
Comments Less than 3 mono-isotopic peaks
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Formula C10H13NO3S
InChI InChI=1S/C10H13NO3S/c1-10(2,3)11-8(12)7-6(9(13)14)4-5-15-7/h4-5H,1-3H3,(H,11,12)(H,13,14)
InChIKey QUZTWSMTEVXSPF-UHFFFAOYSA-N
Molecular Weight 227.278 g/mol
SMILES N(C(c1c(C(=O)O)ccs1)=O)C(C)(C)C
SPLASH splash10-0a4i-0910000000-dfe845808038adbc2573
Source of Spectrum J-50-4366-7
Synonyms 2-(tert-butylcarbamoyl)thiophene-3-carboxylic acid 2-[(tert-butylamino)-oxomethyl]-3-thiophenecarboxylic acid
Wiley ID 1228401