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ETHYL-6-AMINO-4-(4-CHLOROPHENYL)-5-CYANO-2-METHYL-4H-PYRAN-3-CARBOXYLATE
SpectraBase Compound ID 3w0rM6JSVpQ
InChI InChI=1S/C16H15ClN2O3/c1-3-21-16(20)13-9(2)22-15(19)12(8-18)14(13)10-4-6-11(17)7-5-10/h4-7,14H,3,19H2,1-2H3
InChIKey BZLJSLREZDBQBR-UHFFFAOYSA-N
Mol Weight 318.76 g/mol
Molecular Formula C16H15ClN2O3
Exact Mass 318.07712 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HtVCxxjdiz2
Name 6-amino-4-(4-chlorophenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester
Alternate Name(s) ethyl 6-amino-4-(4-chlorophenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate ethyl 6-azanyl-4-(4-chlorophenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C16H15ClN2O3
InChI InChI=1S/C16H15ClN2O3/c1-3-21-16(20)13-9(2)22-15(19)12(8-18)14(13)10-4-6-11(17)7-5-10/h4-7,14H,3,19H2,1-2H3
InChIKey BZLJSLREZDBQBR-UHFFFAOYSA-N
Molecular Weight 318.760 g/mol
SMILES NC=1OC(=C(C(C1C#N)c1ccc(cc1)Cl)C(=O)OCC)C
SPLASH splash10-0a4i-0093000000-cdbf272ec5bb3bf16a82
Source of Spectrum H1-51-1103-7
Wiley ID 817136