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Acetic acid, (6-methoxy-3-oxo-1(3H)-isobenzofuranylidene)-, ethyl ester, (E)-
SpectraBase Compound ID KVoZu4V0mZx
InChI InChI=1S/C13H12O5/c1-3-17-12(14)7-11-10-6-8(16-2)4-5-9(10)13(15)18-11/h4-7H,3H2,1-2H3/b11-7+
InChIKey ZQIUAHMORBMXGS-YRNVUSSQSA-N
Mol Weight 248.23 g/mol
Molecular Formula C13H12O5
Exact Mass 248.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7R4ncx6AVjE
Name Acetic acid, (6-methoxy-3-oxo-1(3H)-isobenzofuranylidene)-, ethyl ester, (E)-
CAS Registry Number 83465-54-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12O5
InChI InChI=1S/C13H12O5/c1-3-17-12(14)7-11-10-6-8(16-2)4-5-9(10)13(15)18-11/h4-7H,3H2,1-2H3/b11-7+
InChIKey ZQIUAHMORBMXGS-YRNVUSSQSA-N
Molecular Weight 248.234 g/mol
SMILES C1(O\C(c2c1ccc(c2)OC)=C/C(=O)OCC)=O
SPLASH splash10-0fb9-0970000000-5961f7dacadf1ce447de
Source of Spectrum KC-1982-1861-0
Synonyms (E)-3-Ethoxycarbonylmethylidene-5-methoxyphthalide Ethyl (2E)-(6-methoxy-3-oxo-2-benzofuran-1(3H)-ylidene)ethanoate
Wiley ID 1250861