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2H-1-Benzopyran-2-one, 3-[2-(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]-
SpectraBase Compound ID 4fPiSHD0yuK
InChI InChI=1S/C13H7Cl2N3O3/c14-12-16-13(15)18(17-12)6-9(19)8-5-7-3-1-2-4-10(7)21-11(8)20/h1-5H,6H2
InChIKey ACIJLVMBHSTHLJ-UHFFFAOYSA-N
Mol Weight 324.12 g/mol
Molecular Formula C13H7Cl2N3O3
Exact Mass 322.986446 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HZuSGCZW5S7
Name 2H-1-Benzopyran-2-one, 3-[2-(3,5-dichloro-1H-1,2,4-triazol-1-yl)acetyl]-
Alternate Name(s) 3-[2-(3,5-dichloro-1,2,4-triazol-1-yl)-1-oxoethyl]-1-benzopyran-2-one 3-[2-(3,5-dichloro-1,2,4-triazol-1-yl)acetyl]chromen-2-one 3-[2-[3,5-bis(chloranyl)-1,2,4-triazol-1-yl]ethanoyl]chromen-2-one
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Formula C13H7Cl2N3O3
InChI InChI=1S/C13H7Cl2N3O3/c14-12-16-13(15)18(17-12)6-9(19)8-5-7-3-1-2-4-10(7)21-11(8)20/h1-5H,6H2
InChIKey ACIJLVMBHSTHLJ-UHFFFAOYSA-N
Molecular Weight 324.123 g/mol
SMILES C=1(C(Oc2ccccc2C1)=O)C(C[n]1c(nc(n1)Cl)Cl)=O
SPLASH splash10-00di-9800000000-b4f89021fb2dcb763dfc
Source of Spectrum IY-2-4703-8
Wiley ID 1655021