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XYRIDIN-A;3-N-PROPYL-6,7-(METHYLENEDIOXY)-ISOCOUMARIN
SpectraBase Compound ID Bc1uv80a4i1
InChI InChI=1S/C13H12O4/c1-2-3-9-4-8-5-11-12(16-7-15-11)6-10(8)13(14)17-9/h4-6H,2-3,7H2,1H3
InChIKey UQMOOBFMUJITLL-UHFFFAOYSA-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 4z3Aw1Ree2t
Name Xyridin A
Alternate Name(s) 3-Propyl-6,7-(methylenedioxy)-isocoumarin 3-n-Propyl-6,7-(methylenedioxy)isocoumarin 7-Propyl-[1,3]dioxolo[4,5-g][2]benzopyran-5-one 7-Propyl-5H-[1,3]dioxolo[4,5-g][2]benzopyran-5-one 7-Propyl-[1,3]dioxolo[4,5-g]isochromen-5-one 7-Propyl-5H-[1,3]dioxolo[4,5-g]isochromen-5-one
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Formula C13H12O4
InChI InChI=1S/C13H12O4/c1-2-3-9-4-8-5-11-12(16-7-15-11)6-10(8)13(14)17-9/h4-6H,2-3,7H2,1H3
InChIKey UQMOOBFMUJITLL-UHFFFAOYSA-N
Molecular Weight 232.235 g/mol
SMILES c1c2c(cc3c1C(=O)OC(=C3)CCC)OCO2
SPLASH splash10-001i-0190000000-9f284314276882d91674
Source of Spectrum Y1-45B-822-1a
Wiley ID 1744458