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Ethyl (E)-3-(5'-oxo-3'-phenyl-2',5'-dihydroisoxazol-2'-yl)propenoate
SpectraBase Compound ID G93pbI5A8MX
InChI InChI=1S/C14H13NO4/c1-2-18-13(16)8-9-15-12(10-14(17)19-15)11-6-4-3-5-7-11/h3-10H,2H2,1H3/b9-8+
InChIKey VDKNHXTXCGBMEG-CMDGGOBGSA-N
Mol Weight 259.26 g/mol
Molecular Formula C14H13NO4
Exact Mass 259.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID q1Wu58FXst
Name Ethyl (E)-3-(5'-oxo-3'-phenyl-2',5'-dihydroisoxazol-2'-yl)propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NO4
InChI InChI=1S/C14H13NO4/c1-2-18-13(16)8-9-15-12(10-14(17)19-15)11-6-4-3-5-7-11/h3-10H,2H2,1H3/b9-8+
InChIKey VDKNHXTXCGBMEG-CMDGGOBGSA-N
Molecular Weight 259.261 g/mol
SMILES C=1(N(OC(C1)=O)\C=C\C(=O)OCC)c1ccccc1
SPLASH splash10-0o70-1950000000-1a7b14b245b98d5e2369
Source of Spectrum B-53-670-19
Synonyms Ethyl (2E)-3-(5-oxo-3-phenyl-2(5H)-isoxazolyl)-2-propenoate Ethyl (E)-3-(5'-oxo-3'-phenyl-2',3'-dihydroisoxazol-2'-yl)propenoate
Wiley ID 746931