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Ethyl (3R,5S,6E)-7-[2-(cyclopropyl)-4-(4-fluorophenyl)quiolin-3-yl]-3,5-syn-isopropylidenedioxy-6-heptenoate
SpectraBase Compound ID 7ULm6WPa8ai
InChI InChI=1S/C30H32FNO4/c1-4-34-27(33)18-23-17-22(35-30(2,3)36-23)15-16-25-28(19-11-13-21(31)14-12-19)24-7-5-6-8-26(24)32-29(25)20-9-10-20/h5-8,11-16,20,22-23H,4,9-10,17-18H2,1-3H3/b16-15+
InChIKey FOGVGUUFLYECEF-FOCLMDBBSA-N
Mol Weight 489.6 g/mol
Molecular Formula C30H32FNO4
Exact Mass 489.231537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24IyNzzgJn1
Name Ethyl (3R,5S,6E)-7-[2-(cyclopropyl)-4-(4-fluorophenyl)quiolin-3-yl]-3,5-syn-isopropylidenedioxy-6-heptenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H32FNO4
InChI InChI=1S/C30H32FNO4/c1-4-34-27(33)18-23-17-22(35-30(2,3)36-23)15-16-25-28(19-11-13-21(31)14-12-19)24-7-5-6-8-26(24)32-29(25)20-9-10-20/h5-8,11-16,20,22-23H,4,9-10,17-18H2,1-3H3/b16-15+
InChIKey FOGVGUUFLYECEF-FOCLMDBBSA-N
Molecular Weight 489.587 g/mol
SMILES c1(c(nc2c(c1-c1ccc(cc1)F)cccc2)C1CC1)\C=C\C1OC(C)(C)OC(C1)CC(=O)OCC
SPLASH splash10-000i-0090200000-d38eeab384af46a50f43
Source of Spectrum AT-34-8270-1
Wiley ID 852631