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Cyclopentanecarboxylic Acid-, 3-(2,2-dimethyl-1-oxopropoxy)-4-ethenyl 1,1-dimethylethyl ester(1.alpha.,3.alpha.,4.alpha.)

View entire compound with spectra: 1 MS (GC)

Cyclopentanecarboxylic Acid-, 3-(2,2-dimethyl-1-oxopropoxy)-4-ethenyl 1,1-dimethylethyl ester(1.alpha.,3.alpha.,4.alpha.)
SpectraBase Compound ID 43NkMv2SYNX
InChI InChI=1S/C17H28O4/c1-8-11-9-12(14(18)21-17(5,6)7)10-13(11)20-15(19)16(2,3)4/h8,11-13H,1,9-10H2,2-7H3/t11-,12+,13+/m1/s1
InChIKey KXYUVOPEWSUOCD-AGIUHOORSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33UaaojrKcz
Name Cyclopentanecarboxylic Acid-, 3-(2,2-dimethyl-1-oxopropoxy)-4-ethenyl 1,1-dimethylethyl ester(1.alpha.,3.alpha.,4.alpha.)
Alternate Name(s) tert-butyl (1S,3S,4S)-3-[(2,2-dimethylpropanoyl)oxy]-4-vinylcyclopentanecarboxylate
CAS Registry Number 113975-53-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-8-11-9-12(14(18)21-17(5,6)7)10-13(11)20-15(19)16(2,3)4/h8,11-13H,1,9-10H2,2-7H3/t11-,12+,13+/m1/s1
InChIKey KXYUVOPEWSUOCD-AGIUHOORSA-N
Molecular Weight 296.407 g/mol
SMILES C(O[C@]1(C[C@@](C(OC(C)(C)C)=O)(C[C@]1(C=C)[H])[H])[H])(C(C)(C)C)=O
SPLASH splash10-0006-0090000000-fb059d38ad2d04a3470a
Source of Spectrum J-57-108-18
Wiley ID 1299212