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5(E)-[(4-Carbomethoxyphenyl)methylidene]tetrahydrofuran-2-one
SpectraBase Compound ID LM40sWfH7cU
InChI InChI=1S/C13H12O4/c1-16-13(15)10-4-2-9(3-5-10)8-11-6-7-12(14)17-11/h2-5,8H,6-7H2,1H3/b11-8+
InChIKey PVDOTNIVKNVKAM-DHZHZOJOSA-N
Mol Weight 232.23 g/mol
Molecular Formula C13H12O4
Exact Mass 232.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B25lpQ7P2YK
Name 5(E)-[(4-Carbomethoxyphenyl)methylidene]tetrahydrofuran-2-one
Alternate Name(s) methyl 4-[(E)-(5-oxodihydro-2(3H)-furanylidene)methyl]benzoate
CAS Registry Number 137742-29-1
Comments Less than 3 mono-isotopic peaks
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Formula C13H12O4
InChI InChI=1S/C13H12O4/c1-16-13(15)10-4-2-9(3-5-10)8-11-6-7-12(14)17-11/h2-5,8H,6-7H2,1H3/b11-8+
InChIKey PVDOTNIVKNVKAM-DHZHZOJOSA-N
Molecular Weight 232.235 g/mol
SMILES c1(\C=C\2OC(CC2)=O)ccc(C(=O)OC)cc1
SPLASH splash10-000t-0980000000-07b8196af0ef1f9228e1
Source of Spectrum J-57-980-6
Wiley ID 1233740