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2,2-Dimethylpropanoic acid 4-(3-oxocyclohexyl)butyl ester
SpectraBase Compound ID E5PLMqQ0qz9
InChI InChI=1S/C15H26O3/c1-15(2,3)14(17)18-10-5-4-7-12-8-6-9-13(16)11-12/h12H,4-11H2,1-3H3
InChIKey INOXFBFZOXBYMQ-UHFFFAOYSA-N
Mol Weight 254.37 g/mol
Molecular Formula C15H26O3
Exact Mass 254.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3pekGb2A0dS
Name 2,2-Dimethylpropanoic acid 4-(3-oxocyclohexyl)butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O3
InChI InChI=1S/C15H26O3/c1-15(2,3)14(17)18-10-5-4-7-12-8-6-9-13(16)11-12/h12H,4-11H2,1-3H3
InChIKey INOXFBFZOXBYMQ-UHFFFAOYSA-N
Molecular Weight 254.370 g/mol
SMILES C(C(C)(C)C)(=O)OCCCCC1CC(=O)CCC1
SPLASH splash10-0a4j-9000000000-90f02ca6b2f724daae35
Source of Spectrum J-61-7479-7
Synonyms 2,2-Dimethylpropionic acid 4-(3-ketocyclohexyl)butyl ester 4-(3-oxidanylidenecyclohexyl)butyl 2,2-dimethylpropanoate 4-(3-oxocyclohexyl)butyl 2,2-dimethylpropanoate
Wiley ID 1257990