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Ethyl 6-amino-5-cyano-4-(3-iodophenyl)-2-methyl-4H-pyran-3-carboxylate
SpectraBase Compound ID HBGZpzbcz9J
InChI InChI=1S/C16H15IN2O3/c1-3-21-16(20)13-9(2)22-15(19)12(8-18)14(13)10-5-4-6-11(17)7-10/h4-7,14H,3,19H2,1-2H3
InChIKey ZDNPASVKQISNOI-UHFFFAOYSA-N
Mol Weight 410.21 g/mol
Molecular Formula C16H15IN2O3
Exact Mass 410.012737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5eUE3cznvL
Name Ethyl 6-amino-5-cyano-4-(3-iodophenyl)-2-methyl-4H-pyran-3-carboxylate
Alternate Name(s) 6-Amino-5-cyano-4-(3-iodophenyl)-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Ethyl 6-azanyl-5-cyano-4-(3-iodanylphenyl)-2-methyl-4H-pyran-3-carboxylate
CAS Registry Number 299198-05-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15IN2O3
InChI InChI=1S/C16H15IN2O3/c1-3-21-16(20)13-9(2)22-15(19)12(8-18)14(13)10-5-4-6-11(17)7-10/h4-7,14H,3,19H2,1-2H3
InChIKey ZDNPASVKQISNOI-UHFFFAOYSA-N
Molecular Weight 410.211 g/mol
SMILES NC1=C(C(C(=C(O1)C)C(OCC)=O)c1cc(ccc1)I)C#N
SPLASH splash10-0a4i-9550000000-7e08d5eab3a39e2c08bd
Wiley ID 1461651