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Ethyl 3-Benzoylisoxazolecarboxylate
SpectraBase Compound ID AM7Do9BnXje
InChI InChI=1S/C13H11NO4/c1-2-17-13(16)10-8-18-14-11(10)12(15)9-6-4-3-5-7-9/h3-8H,2H2,1H3
InChIKey BPVKSIBEGXWYKS-UHFFFAOYSA-N
Mol Weight 245.23 g/mol
Molecular Formula C13H11NO4
Exact Mass 245.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRer6kNYXsT
Name Ethyl 3-Benzoylisoxazolecarboxylate
Alternate Name(s) Ethyl 3-benzoyl-4-isoxazolecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO4
InChI InChI=1S/C13H11NO4/c1-2-17-13(16)10-8-18-14-11(10)12(15)9-6-4-3-5-7-9/h3-8H,2H2,1H3
InChIKey BPVKSIBEGXWYKS-UHFFFAOYSA-N
Molecular Weight 245.234 g/mol
SMILES c1(c(C(=O)c2ccccc2)noc1)C(=O)OCC
SPLASH splash10-0a6r-6900000000-c4c5d74c73f9a9a92181
Source of Spectrum KC-60-1680-18
Wiley ID 1583411