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2-Acetyl-5-methylcyclopentanecarboxylic acid
SpectraBase Compound ID IvgllKuGUKw
InChI InChI=1S/C9H14O3/c1-5-3-4-7(6(2)10)8(5)9(11)12/h5,7-8H,3-4H2,1-2H3,(H,11,12)
InChIKey SDZSRLJJHUZPEP-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 GTvtQCTnX3x
Name 2-Acetyl-5-methylcyclopentanecarboxylic acid
Alternate Name(s) 2-Acetyl-5-methyl-1-cyclopentanecarboxylic acid 2-Acetyl-5-methylcyclopentane-1-carboxylic acid 2-Ethanoyl-5-methyl-cyclopentane-1-carboxylic acid Cyclopentanecarboxylic acid, 2-acetyl-5-methyl-
CAS Registry Number 528-25-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-5-3-4-7(6(2)10)8(5)9(11)12/h5,7-8H,3-4H2,1-2H3,(H,11,12)
InChIKey SDZSRLJJHUZPEP-UHFFFAOYSA-N
Molecular Weight 170.208 g/mol
SMILES OC(C1C(CCC1C)C(=O)C)=O
SPLASH splash10-000x-9300000000-4a1e8929d1d4b9a2bf15
Wiley ID 1489898