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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 iSXY9aTDBg
Name 2-THIOPHENECARBOXYLIC ACID, 5-tert-BUTYL-
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 184.055800798 u
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
Nominal Mass 184 u
Number of Peaks 66
SMILES c1cc(C(C)(C)C)sc1C(O)=O
SPLASH splash10-014i-4900000000-8d548d66fe9f3090a049
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX000938