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

*Links on SpectraBase are not permalinks.
2-[2-[3-[2-(1,3-dioxo-2-isoindolyl)ethyl]-9-oxo-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-7-yl]ethyl]isoindole-1,3-dione
SpectraBase Compound ID y6z6Wewdia
InChI InChI=1S/C39H34N4O5/c44-33-29-15-7-8-16-30(29)34(45)42(33)21-19-40-23-38(27-11-3-1-4-12-27)24-41(26-39(25-40,37(38)48)28-13-5-2-6-14-28)20-22-43-35(46)31-17-9-10-18-32(31)36(43)47/h1-18H,19-26H2/t38-,39+
InChIKey ZGSBQRIWXOSZLZ-PDZRJKAFSA-N
Mol Weight 638.7 g/mol
Molecular Formula C39H34N4O5
Exact Mass 638.25292 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 HuRA4c6gd4C
Name 2-[2-[3-[2-(1,3-dioxo-2-isoindolyl)ethyl]-9-oxo-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-7-yl]ethyl]isoindole-1,3-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H34N4O5
InChI InChI=1S/C39H34N4O5/c44-33-29-15-7-8-16-30(29)34(45)42(33)21-19-40-23-38(27-11-3-1-4-12-27)24-41(26-39(25-40,37(38)48)28-13-5-2-6-14-28)20-22-43-35(46)31-17-9-10-18-32(31)36(43)47/h1-18H,19-26H2/t38-,39+
InChIKey ZGSBQRIWXOSZLZ-PDZRJKAFSA-N
Molecular Weight 638.724 g/mol
SMILES [C@]12(C([C@@](c3ccccc3)(CN(C1)CCN1C(c3ccccc3C1=O)=O)CN(C2)CCN1C(c2ccccc2C1=O)=O)=O)c1ccccc1
SPLASH splash10-014i-0090000000-cfb6f39d68ed794d753d
Source of Spectrum F-51-2074-29
Synonyms 2-[2-[3-[2-(1,3-dioxoisoindol-2-yl)ethyl]-9-oxo-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-7-yl]ethyl]isoindole-1,3-dione 2-[2-[3-[2-(1,3-dioxoisoindolin-2-yl)ethyl]-9-oxo-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-7-yl]ethyl]isoindoline-1,3-dione 2-[2-[3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-9-oxidanylidene-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-7-yl]ethyl]isoindole-1,3-dione 2-[2-[9-keto-1,5-diphenyl-3-(2-phthalimidoethyl)-3,7-diazabicyclo[3.3.1]nonan-7-yl]ethyl]isoindoline-1,3-quinone
Wiley ID 791073