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7-Methylcarbamoylamino-4-chloro-3-ethoxyisocoumarin
SpectraBase Compound ID 74Odxs70Uod
InChI InChI=1S/C13H13ClN2O4/c1-3-19-12-10(14)8-5-4-7(16-13(18)15-2)6-9(8)11(17)20-12/h4-6H,3H2,1-2H3,(H2,15,16,18)
InChIKey ACEFQQAJVYJTAY-UHFFFAOYSA-N
Mol Weight 296.71 g/mol
Molecular Formula C13H13ClN2O4
Exact Mass 296.056385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9XgzIwIwBNu
Name 7-Methylcarbamoylamino-4-chloro-3-ethoxyisocoumarin
Alternate Name(s) N-(4-chloro-3-ethoxy-1-oxo-1H-2-benzopyran-7-yl)-N'-methylurea 1-(4-Chloro-3-ethoxy-1-oxo-2-benzopyran-7-yl)-3-methylurea 1-(4-Chloro-3-ethoxy-1-oxoisochromen-7-yl)-3-methylurea 1-(4-Chloro-3-ethoxy-1-oxo-isochromen-7-yl)-3-methyl-urea 1-(4-Chloranyl-3-ethoxy-1-oxidanylidene-isochromen-7-yl)-3-methyl-urea
CAS Registry Number 120253-70-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClN2O4
InChI InChI=1S/C13H13ClN2O4/c1-3-19-12-10(14)8-5-4-7(16-13(18)15-2)6-9(8)11(17)20-12/h4-6H,3H2,1-2H3,(H2,15,16,18)
InChIKey ACEFQQAJVYJTAY-UHFFFAOYSA-N
Molecular Weight 296.710 g/mol
SMILES N(C(=O)NC)c1ccc2C(=C(OC(=O)c2c1)OCC)Cl
SPLASH splash10-03ea-1690000000-01302bdbe7896e523125
Source of Spectrum GT-1992-54-0
Wiley ID 1298697