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3-Acetyl-2,2-dimethyl-1-cyclobutanecarboxylic acid
SpectraBase Compound ID 2Mj0UPcQcoq
InChI InChI=1S/C9H14O3/c1-5(10)6-4-7(8(11)12)9(6,2)3/h6-7H,4H2,1-3H3,(H,11,12)
InChIKey VZUKBNZKASVATD-UHFFFAOYSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2qwIDwcJxgZ
Name 3-Acetyl-2,2-dimethyl-1-cyclobutanecarboxylic acid
Alternate Name(s) 3-Acetyl-2,2-dimethyl-cyclobutanecarboxylic acid 3-Acetyl-2,2-dimethylcyclobutane-1-carboxylic acid 3-Ethanoyl-2,2-dimethyl-cyclobutane-1-carboxylic acid
CAS Registry Number 22571-78-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-5(10)6-4-7(8(11)12)9(6,2)3/h6-7H,4H2,1-3H3,(H,11,12)
InChIKey VZUKBNZKASVATD-UHFFFAOYSA-N
Molecular Weight 170.208 g/mol
SMILES OC(C1C(C(C1)C(=O)C)(C)C)=O
SPLASH splash10-0006-9000000000-fad9d1d488c1faf7c8bc
Source of Spectrum J-52-691-8
Wiley ID 1166608