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Ethyl 2-(3',5'-dimethyl-4'-isoxazolyl)-4-pentenoate

View entire compound with spectra: 1 MS (GC)

Ethyl 2-(3',5'-dimethyl-4'-isoxazolyl)-4-pentenoate
SpectraBase Compound ID JBcJBDcZcIw
InChI InChI=1S/C12H17NO3/c1-5-7-10(12(14)15-6-2)11-8(3)13-16-9(11)4/h5,10H,1,6-7H2,2-4H3
InChIKey IABQCWIISBNHFC-UHFFFAOYSA-N
Mol Weight 223.27 g/mol
Molecular Formula C12H17NO3
Exact Mass 223.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K9ixROeum28
Name Ethyl 2-(3',5'-dimethyl-4'-isoxazolyl)-4-pentenoate
Alternate Name(s) Ethyl 2-(3,5-dimethyl-4-isoxazolyl)-4-pentenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO3
InChI InChI=1S/C12H17NO3/c1-5-7-10(12(14)15-6-2)11-8(3)13-16-9(11)4/h5,10H,1,6-7H2,2-4H3
InChIKey IABQCWIISBNHFC-UHFFFAOYSA-N
Molecular Weight 223.272 g/mol
SMILES c1(c(onc1C)C)C(C(=O)OCC)CC=C
SPLASH splash10-000x-5900000000-4f76b33a269c9e51c509
Source of Spectrum Y4-83-190-14
Wiley ID 1549987