(3R,4R,6R)-N-Allyl-6-{[4-(3-hydroxyphenyl)-1H-1,2,3-triazol-1-yl]methyl}-N-methylquinuclidine-3-carboxamide

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Systematic / IUPAC Name: (3R,4R,6R)-6-[[4-(3-Hydroxyphenyl)triazol-1-yl]methyl]-N-methyl-N-prop-2-enyl-1-azabicyclo[2.2.2]octane-3-carboxamide

ID: Reference8919

Other Names: 1-Azabicyclo[2.2.2]octane-3-carboxamide, 6-[[4-(3-hydroxyphenyl)-1H-1,2,3-triazol-1-yl]methyl]-N-methyl-N-2-propen-1-yl-, (3R,4R,6R)-;
NAT13-309229

Formula: C21H27N5O2

Spectral Data

(3R,4R,6R)-N-Allyl-6-{[4-(3-hydroxyphenyl)-1H-1,2,3-triazol-1-yl]methyl}-N-methylquinuclidine-3-carboxamide 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 2853
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 9/13/2019 10:52:13 AM
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Identificators

InChI InChI=1S/C21H27N5O2/c1-3-8-24(2)21(28)19-13-25-9-7-15(19)10-17(25)12-26-14-20(22-23-26)16-5-4-6-18(27)11-16/h3-6,11,14-15,17,19,27H,1,7-10,12-13H2,2H3/t15-,17-,19+/m1/s1
InChI Key JJMFDTCEBJBJFZ-SUMDDJOVSA-N
Canonical SMILES CN(CC=C)C(=O)C1CN2CCC1CC2CN3C=C(N=N3)C4=CC(=CC=C4)O
CAS
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Other Names 1-Azabicyclo[2.2.2]octane-3-carboxamide, 6-[[4-(3-hydroxyphenyl)-1H-1,2,3-triazol-1-yl]methyl]-N-methyl-N-2-propen-1-yl-, (3R,4R,6R)-;
NAT13-309229

In Other Databases

ChemSpider 10117082
PubChem 11942763