{(2R,4S,5R)-5-[1-Methyl-3-(2-naphthyl)-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl}methyl (4-acetylphenyl)carbamate

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Systematic / IUPAC Name: [(2R,4S,5R)-5-(2-Methyl-5-naphthalen-2-ylpyrazol-3-yl)-1-azabicyclo[2.2.2]octan-2-yl]methyl N-(4-acetylphenyl)carbamate

ID: Reference9145

Other Names: Carbamic acid, N-(4-acetylphenyl)-, [(2R,4S,5R)-5-[1-methyl-3-(2-naphthalenyl)-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl]methyl ester;
NAT13-338995

Formula: C31H32N4O3

Spectral Data

{(2R,4S,5R)-5-[1-Methyl-3-(2-naphthyl)-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl}methyl (4-acetylphenyl)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 760
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 11/22/2019 12:21:47 PM
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Identificators

InChI InChI=1S/C31H32N4O3/c1-20(36)21-9-11-26(12-10-21)32-31(37)38-19-27-16-24-13-14-35(27)18-28(24)30-17-29(33-34(30)2)25-8-7-22-5-3-4-6-23(22)15-25/h3-12,15,17,24,27-28H,13-14,16,18-19H2,1-2H3,(H,32,37)/t24-,27+,28-/m0/s1
InChI Key AIHQSJOGVYRKAD-VCTRFXNDSA-N
Canonical SMILES CC(=O)C1=CC=C(C=C1)NC(=O)OCC2CC3CCN2CC3C4=CC(=NN4C)C5=CC6=CC=CC=C6C=C5
CAS
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Other Names Carbamic acid, N-(4-acetylphenyl)-, [(2R,4S,5R)-5-[1-methyl-3-(2-naphthalenyl)-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]oct-2-yl]methyl ester;
NAT13-338995

In Other Databases

ChemSpider 21381235
PubChem 44716363