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Rac-3-(3-Oxo-2-pentylcyclopentyl)-propionic acid methyl ester
SpectraBase Compound ID HcomCgIxDR6
InChI InChI=1S/C14H24O3/c1-3-4-5-6-12-11(7-9-13(12)15)8-10-14(16)17-2/h11-12H,3-10H2,1-2H3
InChIKey BNCQLPGDYIMEFV-UHFFFAOYSA-N
Mol Weight 240.34 g/mol
Molecular Formula C14H24O3
Exact Mass 240.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A2i1f4qpVUq
Name Rac-3-(3-Oxo-2-pentylcyclopentyl)-propionic acid methyl ester
Alternate Name(s) Methyl 3-(3-oxo-2-pentylcyclopentyl)propanoate 3-(3-oxo-2-pentylcyclopentyl)propanoic acid methyl ester Methyl 3-(3-oxo-2-pentyl-cyclopentyl)propanoate Methyl 3-(3-oxidanylidene-2-pentyl-cyclopentyl)propanoate
Comments Removed - unrepairable contamination (CH2Cl2)
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Formula C14H24O3
InChI InChI=1S/C14H24O3/c1-3-4-5-6-12-11(7-9-13(12)15)8-10-14(16)17-2/h11-12H,3-10H2,1-2H3
InChIKey BNCQLPGDYIMEFV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200600468
Molecular Weight 240.343 g/mol
SMILES C(=O)(OC)CCC1C(C(CC1)=O)CCCCC
SPLASH splash10-000t-9020000000-84d9dc65e703bba23b23
Source of Spectrum ASC-349-923-33
Wiley ID 1765572