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Butanoic acid, 3-oxo-, 1-(2-methyl-1-cyclopenten-1-yl)ethyl ester, (.+-.)-
SpectraBase Compound ID 7YlaAyo4cne
InChI InChI=1S/C12H18O3/c1-8-5-4-6-11(8)10(3)15-12(14)7-9(2)13/h10H,4-7H2,1-3H3
InChIKey NINVSMUNDNISJA-UHFFFAOYSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IIEnZOVSI7
Name Butanoic acid, 3-oxo-, 1-(2-methyl-1-cyclopenten-1-yl)ethyl ester, (.+-.)-
Alternate Name(s) 1-(2-Methyl-1-cyclopenten-1-yl)ethyl 3-oxobutanoate 1-(2-Methyl-1-cyclopentenyl)ethyl 3-oxobutanoate
CAS Registry Number 116005-91-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-8-5-4-6-11(8)10(3)15-12(14)7-9(2)13/h10H,4-7H2,1-3H3
InChIKey NINVSMUNDNISJA-UHFFFAOYSA-N
Molecular Weight 210.273 g/mol
SMILES C1(C(OC(CC(=O)C)=O)C)=C(CCC1)C
SPLASH splash10-0006-9100000000-5401814dabc2bd7fbd77
Source of Spectrum J-53-4512-9
Wiley ID 1209254