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2-(2-Bromophenyl)-2-methylpropanoic acid
SpectraBase Compound ID 3MVcrdFkZ4s
InChI InChI=1S/C10H11BrO2/c1-10(2,9(12)13)7-5-3-4-6-8(7)11/h3-6H,1-2H3,(H,12,13)
InChIKey FLSGJYHPNFXLSS-UHFFFAOYSA-N
Mol Weight 243.1 g/mol
Molecular Formula C10H11BrO2
Exact Mass 241.994243 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2sdr9ApkoSx
Name 2-(2-Bromophenyl)-2-methylpropanoic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 241.994242592 u
Formula C10H11BrO2
InChI InChI=1S/C10H11BrO2/c1-10(2,9(12)13)7-5-3-4-6-8(7)11/h3-6H,1-2H3,(H,12,13)
InChIKey FLSGJYHPNFXLSS-UHFFFAOYSA-N
Molecular Weight 243.100 g/mol
SMILES C(C=1C(Br)=CC=CC1)(C(=O)O)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.846205