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(3S,4S)-3-(2-Acetoxyethyl)-3-isopropenyl-4-methylcyclopentanone
SpectraBase Compound ID wMZyQAZdGb
InChI InChI=1S/C13H20O3/c1-9(2)13(5-6-16-11(4)14)8-12(15)7-10(13)3/h10H,1,5-8H2,2-4H3/t10-,13+/m0/s1
InChIKey YBQUTNJGARTJRW-GXFFZTMASA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ETQ3UMtdh5u
Name (3S,4S)-3-(2-Acetoxyethyl)-3-isopropenyl-4-methylcyclopentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-9(2)13(5-6-16-11(4)14)8-12(15)7-10(13)3/h10H,1,5-8H2,2-4H3/t10-,13+/m0/s1
InChIKey YBQUTNJGARTJRW-GXFFZTMASA-N
Molecular Weight 224.300 g/mol
SMILES [C@@]1([C@](CC(C1)=O)(C)[H])(C(=C)C)CCOC(=O)C
SPLASH splash10-004l-9400000000-164eaf643ae0d51ac7bd
Source of Spectrum KC-57-1202-9
Synonyms 2-[(1S,2S)-1-isopropenyl-2-methyl-4-oxocyclopentyl]ethyl acetate
Wiley ID 1622861