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Methyl 7-methyl-coumarin-5-carboxylate
SpectraBase Compound ID 50OUSfzFT0r
InChI InChI=1S/C12H10O4/c1-7-5-9(12(14)15-2)8-3-4-11(13)16-10(8)6-7/h3-6H,1-2H3
InChIKey FUPRIJQJHUHACV-UHFFFAOYSA-N
Mol Weight 218.21 g/mol
Molecular Formula C12H10O4
Exact Mass 218.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 412QjX1vwe
Name Methyl 7-methyl-coumarin-5-carboxylate
Appearance Pale yellow powder
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Formula C12H10O4
InChI InChI=1S/C12H10O4/c1-7-5-9(12(14)15-2)8-3-4-11(13)16-10(8)6-7/h3-6H,1-2H3
InChIKey FUPRIJQJHUHACV-UHFFFAOYSA-N
Instrument Name ??Thermo Polaris Q
Ionization Type EI positive ion
Molecular Weight 218.208 g/mol
Reported Formula C12H10O4
SMILES C1(Oc2cc(cc(c2C=C1)C(=O)OC)C)=O
SPLASH splash10-066u-1930000000-0ef358b58819e49674df
Source of Spectrum WO2014019685A1
Thin-Layer Chromatography Rf = 0.59 (silicagel 60, dichloromethane)
Wiley ID 1849967