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

*Links on SpectraBase are not permalinks.
2-Amino-4-(4-(4-(1,3-dioxoisoindolin-2-yl)butoxy)phenyl)-7-methyl-5-oxo-4,5-dihydropyrano[4,3-b]pyran-3-carbonitrile
SpectraBase Compound ID GppKyIutMcV
InChI InChI=1S/C28H23N3O6/c1-16-14-22-24(28(34)36-16)23(21(15-29)25(30)37-22)17-8-10-18(11-9-17)35-13-5-4-12-31-26(32)19-6-2-3-7-20(19)27(31)33/h2-3,6-11,14,23H,4-5,12-13,30H2,1H3
InChIKey DGTCGTOGGSAVPD-UHFFFAOYSA-N
Mol Weight 497.51 g/mol
Molecular Formula C28H23N3O6
Exact Mass 497.158685 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 DPio0d54Ags
Name 2-Amino-4-(4-(4-(1,3-dioxoisoindolin-2-yl)butoxy)phenyl)-7-methyl-5-oxo-4,5-dihydropyrano[4,3-b]pyran-3-carbonitrile
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H23N3O6
InChI InChI=1S/C28H23N3O6/c1-16-14-22-24(28(34)36-16)23(21(15-29)25(30)37-22)17-8-10-18(11-9-17)35-13-5-4-12-31-26(32)19-6-2-3-7-20(19)27(31)33/h2-3,6-11,14,23H,4-5,12-13,30H2,1H3
InChIKey DGTCGTOGGSAVPD-UHFFFAOYSA-N
Instrument Name Agilent Technology
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3204
Molecular Weight 497.507 g/mol
SMILES NC1=C(C(C2=C(O1)C=C(OC2=O)C)c1ccc(cc1)OCCCCN1C(c2c(C1=O)cccc2)=O)C#N
SPLASH splash10-03di-0930000000-529c09176de99db69d0b
Source of Spectrum Y-55-1683-8a
Wiley ID 1879196