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2-Amino-4-[3-(2-chloro-6-fluoro-benzyl)oxyphenyl]-5-keto-7-methyl-4H-pyrano[3,2-c]pyran-3-carbonitrile
SpectraBase Compound ID 30KroZyNSYO
InChI InChI=1S/C23H16ClFN2O4/c1-12-8-19-21(23(28)30-12)20(15(10-26)22(27)31-19)13-4-2-5-14(9-13)29-11-16-17(24)6-3-7-18(16)25/h2-9,20H,11,27H2,1H3
InChIKey ZXAOPXMZDVHUMU-UHFFFAOYSA-N
Mol Weight 438.84 g/mol
Molecular Formula C23H16ClFN2O4
Exact Mass 438.078263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ZMADne6uGJ
Name 2-Amino-4-[3-(2-chloro-6-fluoro-benzyl)oxyphenyl]-5-keto-7-methyl-4H-pyrano[3,2-c]pyran-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H16ClFN2O4
InChI InChI=1S/C23H16ClFN2O4/c1-12-8-19-21(23(28)30-12)20(15(10-26)22(27)31-19)13-4-2-5-14(9-13)29-11-16-17(24)6-3-7-18(16)25/h2-9,20H,11,27H2,1H3
InChIKey ZXAOPXMZDVHUMU-UHFFFAOYSA-N
Molecular Weight 438.842 g/mol
SMILES NC1=C(C(C2=C(O1)C=C(OC2=O)C)c1cc(OCc2c(F)cccc2Cl)ccc1)C#N
SPLASH splash10-0006-7930000000-a8ed23e686efbe1c0fc8
Synonyms 2-Amino-4-[3-[(2-chloro-6-fluoro-phenyl)methoxy]phenyl]-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile 2-Azanyl-4-[3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carbonitrile
Wiley ID 1459401