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4H-Pyran-3-carboxylic acid, 5-cyano-4-[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]-2-methyl-6-(1H-pyrrol-1-yl)-, methyl ester

View entire compound with spectra: 1 MS (GC)

4H-Pyran-3-carboxylic acid, 5-cyano-4-[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]-2-methyl-6-(1H-pyrrol-1-yl)-, methyl ester
SpectraBase Compound ID 3OmY7T7hzlH
InChI InChI=1S/C27H23FN2O5/c1-17-24(27(31)33-3)25(20(15-29)26(35-17)30-12-6-7-13-30)18-10-11-22(23(14-18)32-2)34-16-19-8-4-5-9-21(19)28/h4-14,25H,16H2,1-3H3
InChIKey TXWGCEGZDWOMSV-UHFFFAOYSA-N
Mol Weight 474.49 g/mol
Molecular Formula C27H23FN2O5
Exact Mass 474.1591 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GULeumy09hy
Name 4H-Pyran-3-carboxylic acid, 5-cyano-4-[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]-2-methyl-6-(1H-pyrrol-1-yl)-, methyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H23FN2O5
InChI InChI=1S/C27H23FN2O5/c1-17-24(27(31)33-3)25(20(15-29)26(35-17)30-12-6-7-13-30)18-10-11-22(23(14-18)32-2)34-16-19-8-4-5-9-21(19)28/h4-14,25H,16H2,1-3H3
InChIKey TXWGCEGZDWOMSV-UHFFFAOYSA-N
Molecular Weight 474.488 g/mol
SMILES C=1(C(C(=C(OC1C)[n]1cccc1)C#N)c1cc(c(cc1)OCc1c(cccc1)F)OC)C(=O)OC
SPLASH splash10-0a4i-6931100000-144fc915630db4fdb64f
Source of Spectrum IY-2-5047-4
Synonyms Methyl 5-cyano-4-{4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate 5-cyano-4-[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]-2-methyl-6-(1-pyrrolyl)-4H-pyran-3-carboxylic acid methyl ester Methyl 5-cyano-4-[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate Methyl 5-cyano-4-[4-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate
Wiley ID 1658457