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2-Acetyl-5-keto-3-isoxazoline-3-carboxylic acid ethyl ester
SpectraBase Compound ID KVMo1T2JEQQ
InChI InChI=1S/C8H9NO5/c1-3-13-8(12)6-4-7(11)14-9(6)5(2)10/h4H,3H2,1-2H3
InChIKey ZDKAQOCJKPKLLG-UHFFFAOYSA-N
Mol Weight 199.16 g/mol
Molecular Formula C8H9NO5
Exact Mass 199.048072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57cBJkx6Jt8
Name 2-Acetyl-5-keto-3-isoxazoline-3-carboxylic acid ethyl ester
Alternate Name(s) 2-Acetyl-5-oxo-3-isoxazolecarboxylic acid ethyl ester Ethyl 2-acetyl-5-oxo-1,2-oxazole-3-carboxylate Ethyl 2-acetyl-5-oxo-isoxazole-3-carboxylate Ethyl 2-ethanoyl-5-oxidanylidene-1,2-oxazole-3-carboxylate
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Formula C8H9NO5
InChI InChI=1S/C8H9NO5/c1-3-13-8(12)6-4-7(11)14-9(6)5(2)10/h4H,3H2,1-2H3
InChIKey ZDKAQOCJKPKLLG-UHFFFAOYSA-N
Molecular Weight 199.162 g/mol
SMILES C=1(N(OC(C1)=O)C(=O)C)C(=O)OCC
SPLASH splash10-00fr-0900000000-88b96a36d405de8f8ad2
Source of Spectrum KC-0-2663-1
Wiley ID 823293