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2-Hydroxy-2-(4-isobutylphenyl)propanoic acid
SpectraBase Compound ID Cs1CSq5NaWv
InChI InChI=1S/C13H18O3/c1-9(2)8-10-4-6-11(7-5-10)13(3,16)12(14)15/h4-7,9,16H,8H2,1-3H3,(H,14,15)
InChIKey APEODKDQAWQDLW-UHFFFAOYSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1f70DRH6sVz
Name 2-Hydroxy-2-(4-isobutylphenyl)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-9(2)8-10-4-6-11(7-5-10)13(3,16)12(14)15/h4-7,9,16H,8H2,1-3H3,(H,14,15)
InChIKey APEODKDQAWQDLW-UHFFFAOYSA-N
Molecular Weight 222.284 g/mol
SMILES OC(C(c1ccc(cc1)CC(C)C)(C)O)=O
SPLASH splash10-004i-2910000000-efec44d6b570e6175ac8
Source of Spectrum YongFang Rao, et al. Chemical Engineering Journal, V.283, 2016, P.65-75
Wiley ID 1815399