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ethyl 2-(2,2-dimethylcyclopentyl)propanoate
SpectraBase Compound ID 5GE5WBMO1VC
InChI InChI=1S/C12H22O2/c1-5-14-11(13)9(2)10-7-6-8-12(10,3)4/h9-10H,5-8H2,1-4H3
InChIKey VADRUBNXBGKUKP-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 153eK37xGy
Name ethyl 2-(2,2-dimethylcyclopentyl)propanoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-5-14-11(13)9(2)10-7-6-8-12(10,3)4/h9-10H,5-8H2,1-4H3
InChIKey VADRUBNXBGKUKP-UHFFFAOYSA-N
Instrument Name MSD5975C
Ionization Type EI
Molecular Weight 198.306 g/mol
SMILES C(C)OC(C(C)C1C(CCC1)(C)C)=O
SPLASH splash10-0pb9-9900000000-5b93d22638902e29c236
Sample Comments Major isomer
Source of Spectrum WO2017097884A1
Wiley ID 1855409