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3-(3-p-cumenyloxirane-2-carbonyl)coumarin
SpectraBase Compound ID JfJBVFiSGKN
InChI InChI=1S/C21H18O4/c1-12(2)13-7-9-14(10-8-13)19-20(25-19)18(22)16-11-15-5-3-4-6-17(15)24-21(16)23/h3-12,19-20H,1-2H3
InChIKey SKALCLSKEGATOV-UHFFFAOYSA-N
Mol Weight 334.37 g/mol
Molecular Formula C21H18O4
Exact Mass 334.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1PD0BAHxzt2
Name 3-(3-p-cumenyloxirane-2-carbonyl)coumarin
Alternate Name(s) 3-[3-(4-isopropylphenyl)oxirane-2-carbonyl]chromen-2-one 3-[3-(4-propan-2-ylphenyl)oxiran-2-yl]carbonylchromen-2-one 3-[3-(4-propan-2-ylphenyl)oxirane-2-carbonyl]chromen-2-one 3-[oxo-[3-(4-propan-2-ylphenyl)-2-oxiranyl]methyl]-1-benzopyran-2-one
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Formula C21H18O4
InChI InChI=1S/C21H18O4/c1-12(2)13-7-9-14(10-8-13)19-20(25-19)18(22)16-11-15-5-3-4-6-17(15)24-21(16)23/h3-12,19-20H,1-2H3
InChIKey SKALCLSKEGATOV-UHFFFAOYSA-N
Molecular Weight 334.371 g/mol
SMILES C1(OC1c1ccc(cc1)C(C)C)C(C=1C(Oc2c(C1)cccc2)=O)=O
SPLASH splash10-00di-0900000000-9d24fcca2dddf37f11ea
Source of Spectrum AJ-41-708-14
Wiley ID 1567637