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3-Methyl-2-phenylbutyric acid
SpectraBase Compound ID X2in0w1Osd
InChI InChI=1S/C11H14O2/c1-8(2)10(11(12)13)9-6-4-3-5-7-9/h3-8,10H,1-2H3,(H,12,13)
InChIKey HDLQGISFYDYWFJ-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jqa6vYgRnKc
Name 3-Methyl-2-phenylbutanoic acid
Alternate Name(s) 3-Methyl-2-phenyl-butyric acid
CAS Registry Number 3508-94-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-8(2)10(11(12)13)9-6-4-3-5-7-9/h3-8,10H,1-2H3,(H,12,13)
InChIKey HDLQGISFYDYWFJ-UHFFFAOYSA-N
Molecular Weight 178.231 g/mol
SMILES OC(C(c1ccccc1)C(C)C)=O
SPLASH splash10-002r-1900000000-195f9c2183d6624fe650
Source of Spectrum F-54-816-9
Wiley ID 805278