[(2R,4S,5R)-5-(3-Cyclohexyl-1-methyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]methyl (4-methoxyphenyl)carbamate

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Systematic / IUPAC Name: [(2R,4S,5R)-5-(5-Cyclohexyl-2-methylpyrazol-3-yl)-1-azabicyclo[2.2.2]octan-2-yl]methyl N-(4-methoxyphenyl)carbamate

ID: Reference9032

Other Names: Carbamic acid, N-(4-methoxyphenyl)-, [(2R,4S,5R)-5-(3-cyclohexyl-1-methyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]methyl ester;
NAT13-331777

Formula: C26H36N4O3

Spectral Data

[(2R,4S,5R)-5-(3-Cyclohexyl-1-methyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]methyl (4-methoxyphenyl)carbamate 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 FAIMS
No. of Spectral Trees 1
No. of Spectra 1041
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 10/21/2019 7:36:22 AM
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Identificators

InChI InChI=1S/C26H36N4O3/c1-29-25(15-24(28-29)18-6-4-3-5-7-18)23-16-30-13-12-19(23)14-21(30)17-33-26(31)27-20-8-10-22(32-2)11-9-20/h8-11,15,18-19,21,23H,3-7,12-14,16-17H2,1-2H3,(H,27,31)/t19-,21+,23-/m0/s1
InChI Key JBNPFZBXHXHZKV-WPYKKVEZSA-N
Canonical SMILES CN1C(=CC(=N1)C2CCCCC2)C3CN4CCC3CC4COC(=O)NC5=CC=C(C=C5)OC
CAS
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Other Names Carbamic acid, N-(4-methoxyphenyl)-, [(2R,4S,5R)-5-(3-cyclohexyl-1-methyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]methyl ester;
NAT13-331777

In Other Databases

ChemSpider 21380756
PubChem 40780082