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5-[(1E)-1-(3,7-Dimethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-5-yl)-5-(2-oxo-1,3-oxazolidin-3-yl)pent-1-en-1-yl]-N,2-dimethoxy-3-methylbenzenecarboximidoyl Fluoride

View entire compound with spectra: 1 MS (GC)

5-[(1E)-1-(3,7-Dimethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-5-yl)-5-(2-oxo-1,3-oxazolidin-3-yl)pent-1-en-1-yl]-N,2-dimethoxy-3-methylbenzenecarboximidoyl Fluoride
SpectraBase Compound ID CRlNUiR6HRY
InChI InChI=1S/C27H30FN3O6/c1-16-12-18(14-21(23(16)34-4)25(28)29-35-5)20(8-6-7-9-31-10-11-36-27(31)33)19-13-17(2)24-22(15-19)30(3)26(32)37-24/h8,12-15H,6-7,9-11H2,1-5H3/b20-8+,29-25?
InChIKey GTYDWRYAEZBWID-OJLZICFASA-N
Mol Weight 511.55 g/mol
Molecular Formula C27H30FN3O6
Exact Mass 511.211864 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7E2448T40AF
Name 5-[(1E)-1-(3,7-Dimethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-5-yl)-5-(2-oxo-1,3-oxazolidin-3-yl)pent-1-en-1-yl]-N,2-dimethoxy-3-methylbenzenecarboximidoyl Fluoride
Appearance Clear oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30FN3O6
InChI InChI=1S/C27H30FN3O6/c1-16-12-18(14-21(23(16)34-4)25(28)29-35-5)20(8-6-7-9-31-10-11-36-27(31)33)19-13-17(2)24-22(15-19)30(3)26(32)37-24/h8,12-15H,6-7,9-11H2,1-5H3/b20-8+,29-25?
InChIKey GTYDWRYAEZBWID-OJLZICFASA-N
Ionization Type EI
Molecular Weight 511.550 g/mol
Reported Formula C27H30FN3O6
SMILES c1c(c(c(cc1\C(=C/CCCN1C(OCC1)=O)c1cc2c(c(c1)C)OC(N2C)=O)C)OC)C(F)=NOC
SPLASH splash10-0002-3309100000-91866e40b239dd5be141
Source of Spectrum US20170267667A1
Wiley ID 1866102