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2-Butynoic acid, 4-cyclohexyl-4-oxo-, ethyl ester
SpectraBase Compound ID 3iDaHNYDutC
InChI InChI=1S/C12H16O3/c1-2-15-12(14)9-8-11(13)10-6-4-3-5-7-10/h10H,2-7H2,1H3
InChIKey YUUBUAMDBBUXEP-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ZIfBZQFam7
Name 2-Butynoic acid, 4-cyclohexyl-4-oxo-, ethyl ester
CAS Registry Number 54966-50-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-2-15-12(14)9-8-11(13)10-6-4-3-5-7-10/h10H,2-7H2,1H3
InChIKey YUUBUAMDBBUXEP-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES C(C(=O)C1CCCCC1)#CC(OCC)=O
SPLASH splash10-0a7l-9200000000-e34b04246dda2b817774
Source of Spectrum SD-1981-0-0
Synonyms Ethyl 4-cyclohexyl-4-oxo-2-butynoate 4-cyclohexyl-4-keto-but-2-ynoic acid ethyl ester 4-cyclohexyl-4-oxo-2-butynoic acid ethyl ester Ethyl 4-cyclohexyl-4-oxidanylidene-but-2-ynoate Ethyl 4-cyclohexyl-4-oxo-but-2-ynoate
Wiley ID 1206807