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

*Links on SpectraBase are not permalinks.
3,7-Bis(2-hydroxyphenoxyethyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
SpectraBase Compound ID A3OCkoFTI3p
InChI InChI=1S/C35H36N2O5/c38-29-15-7-9-17-31(29)41-21-19-36-23-34(27-11-3-1-4-12-27)24-37(20-22-42-32-18-10-8-16-30(32)39)26-35(25-36,33(34)40)28-13-5-2-6-14-28/h1-18,38-39H,19-26H2/t34-,35+
InChIKey PWBHGJRNEHRAKM-HJWAMQHWSA-N
Mol Weight 564.7 g/mol
Molecular Formula C35H36N2O5
Exact Mass 564.262422 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 EvjYVKXYcqz
Name 3,7-Bis(2-hydroxyphenoxyethyl)-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H36N2O5
InChI InChI=1S/C35H36N2O5/c38-29-15-7-9-17-31(29)41-21-19-36-23-34(27-11-3-1-4-12-27)24-37(20-22-42-32-18-10-8-16-30(32)39)26-35(25-36,33(34)40)28-13-5-2-6-14-28/h1-18,38-39H,19-26H2/t34-,35+
InChIKey PWBHGJRNEHRAKM-HJWAMQHWSA-N
Molecular Weight 564.682 g/mol
SMILES Oc1c(OCCN2C[C@]3(C([C@](CN(CCOc4c(cccc4)O)C3)(C2)c2ccccc2)=O)c2ccccc2)cccc1
SPLASH splash10-0006-9001000000-7f71d3dcb458b5601f98
Source of Spectrum F-51-4824-5
Synonyms 3,7-bis[2-(2-hydroxyphenoxy)ethyl]-1,5-diphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Wiley ID 791809