2,2-Dimethyl-3-hydroxy-3-(p-tolyl)propionic acid

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Systematic / IUPAC Name: 3-Hydroxy-2,2-dimethyl-3-(4-methylphenyl)propanoic acid

ID: Reference2575

Other Names: 3-Hydroxy-2,2-dimethyl-3-(p-tolyl)propanoic acid

Formula: C12H16O3

Spectral Data

2,2-Dimethyl-3-hydroxy-3-(p-tolyl)propionic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 99
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 4/10/2015 9:01:02 AM
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Identificators

InChI InChI=1S/C12H16O3/c1-8-4-6-9(7-5-8)10(13)12(2,3)11(14)15/h4-7,10,13H,1-3H3,(H,14,15)
InChI Key AQHNAIWQBJLNNS-UHFFFAOYSA-N
Canonical SMILES CC1=CC=C(C=C1)C(C(C)(C)C(=O)O)O
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Other Names 3-Hydroxy-2,2-dimethyl-3-(p-tolyl)propanoic acid

In Other Databases

ChemSpider 2015493
PubChem 2733717