1-{[(2R,4S,5R)-5-Ethyl-1-azabicyclo[2.2.2]oct-2-yl]methyl}-3-(4-phenoxyphenyl)urea

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Systematic / IUPAC Name: 1-[[(2R,4S,5R)-5-Ethyl-1-azabicyclo[2.2.2]octan-2-yl]methyl]-3-(4-phenoxyphenyl)urea

ID: Reference10811

Other Names: Urea, N-[[(2R,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]oct-2-yl]methyl]-N'-(4-phenoxyphenyl)-;
NAT13-337399

Formula: C23H29N3O2

Spectral Data

1-{[(2R,4S,5R)-5-Ethyl-1-azabicyclo[2.2.2]oct-2-yl]methyl}-3-(4-phenoxyphenyl)urea mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 965
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 9/2/2021 8:23:39 AM
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Identificators

InChI InChI=1S/C23H29N3O2/c1-2-17-16-26-13-12-18(17)14-20(26)15-24-23(27)25-19-8-10-22(11-9-19)28-21-6-4-3-5-7-21/h3-11,17-18,20H,2,12-16H2,1H3,(H2,24,25,27)/t17-,18-,20+/m0/s1
InChI Key WMZGLBPNDYEISB-CMKODMSKSA-N
Canonical SMILES CCC1CN2CCC1CC2CNC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4
CAS
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Other Names Urea, N-[[(2R,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]oct-2-yl]methyl]-N'-(4-phenoxyphenyl)-;
NAT13-337399

In Other Databases

ChemSpider 10117637
PubChem 11943318