For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4,6-Bis-(4-ethoxycarbonyl-3-phenylamino-5-oxo-2,5-dihydroisoxazolin-2-yl)pyrimidine
SpectraBase Compound ID BW4Z1WJ5MXc
InChI InChI=1S/C28H24N6O8/c1-3-39-25(35)21-23(31-17-11-7-5-8-12-17)33(41-27(21)37)19-15-20(30-16-29-19)34-24(32-18-13-9-6-10-14-18)22(28(38)42-34)26(36)40-4-2/h5-16,31-32H,3-4H2,1-2H3
InChIKey KFGZYCUIAMJUCD-UHFFFAOYSA-N
Mol Weight 572.53 g/mol
Molecular Formula C28H24N6O8
Exact Mass 572.165562 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9otLQUGWS2s
Name 4,6-Bis-(4-ethoxycarbonyl-3-phenylamino-5-oxo-2,5-dihydroisoxazolin-2-yl)pyrimidine
Appearance White crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H24N6O8
InChI InChI=1S/C28H24N6O8/c1-3-39-25(35)21-23(31-17-11-7-5-8-12-17)33(41-27(21)37)19-15-20(30-16-29-19)34-24(32-18-13-9-6-10-14-18)22(28(38)42-34)26(36)40-4-2/h5-16,31-32H,3-4H2,1-2H3
InChIKey KFGZYCUIAMJUCD-UHFFFAOYSA-N
Instrument Name Varian Matt 311
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.c03
Molecular Weight 572.534 g/mol
SMILES N(C1=C(C(ON1c1cc(N2C(=C(C(O2)=O)C(OCC)=O)Nc2ccccc2)ncn1)=O)C(OCC)=O)c1ccccc1
SPLASH splash10-0aos-0950100000-38734e5dd53df9b3113b
Source of Spectrum ARK-2009-27-14
Wiley ID 1869754