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2-Butynoic acid, 4-cyclobutyl-4-oxo-, ethyl ester
SpectraBase Compound ID 4g0N1zECER9
InChI InChI=1S/C10H12O3/c1-2-13-10(12)7-6-9(11)8-4-3-5-8/h8H,2-5H2,1H3
InChIKey FCDUKTAAWQRJQG-UHFFFAOYSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDZOdY6D2e8
Name 2-Butynoic acid, 4-cyclobutyl-4-oxo-, ethyl ester
CAS Registry Number 54966-51-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-2-13-10(12)7-6-9(11)8-4-3-5-8/h8H,2-5H2,1H3
InChIKey FCDUKTAAWQRJQG-UHFFFAOYSA-N
Molecular Weight 180.203 g/mol
SMILES C1(C(C#CC(OCC)=O)=O)CCC1
SPLASH splash10-0a4i-9100000000-85893e87e6a147ee7f82
Source of Spectrum SD-1981-0-0
Synonyms Ethyl 4-cyclobutyl-4-oxo-2-butynoate 4-cyclobutyl-4-keto-but-2-ynoic acid ethyl ester 4-cyclobutyl-4-oxo-2-butynoic acid ethyl ester Ethyl 4-cyclobutyl-4-oxidanylidene-but-2-ynoate Ethyl 4-cyclobutyl-4-oxo-but-2-ynoate
Wiley ID 1176071