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Ethyl 3-acetoxy-3-[3-(4-methylphenyl)isoxazol-5-yl]-2-methylenepropanoate
SpectraBase Compound ID LRKibm69Buh
InChI InChI=1S/C18H19NO5/c1-5-22-18(21)12(3)17(23-13(4)20)16-10-15(19-24-16)14-8-6-11(2)7-9-14/h6-10,17H,3,5H2,1-2,4H3
InChIKey ZGTSIXVVTPOXPR-UHFFFAOYSA-N
Mol Weight 329.35 g/mol
Molecular Formula C18H19NO5
Exact Mass 329.126323 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4IrdOcujod1
Name Ethyl 3-acetoxy-3-[3-(4-methylphenyl)isoxazol-5-yl]-2-methylenepropanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.126322711 u
Formula C18H19NO5
InChI InChI=1S/C18H19NO5/c1-5-22-18(21)12(3)17(23-13(4)20)16-10-15(19-24-16)14-8-6-11(2)7-9-14/h6-10,17H,3,5H2,1-2,4H3
InChIKey ZGTSIXVVTPOXPR-UHFFFAOYSA-N
Molecular Weight 329.352 g/mol
SMILES C1(=CC(C2=CC=C(C=C2)C)=NO1)C(C(C(=O)OCC)=C)OC(=O)C