N-(2-Cyanoethyl)-2-[(3R,4S)-3-ethyl-1-(2-hydroxy-4-methoxybenzyl)-4-piperidinyl]-N-methylacetamide

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Systematic / IUPAC Name: N-(2-Cyanoethyl)-2-[(3R,4S)-3-ethyl-1-[(2-hydroxy-4-methoxyphenyl)methyl]piperidin-4-yl]-N-methylacetamide

ID: Reference9351

Other Names: 4-Piperidineacetamide, N-(2-cyanoethyl)-3-ethyl-1-[(2-hydroxy-4-methoxyphenyl)methyl]-N-methyl-, (3R,4S)-;
NAT14-324056

Formula: C21H31N3O3

Spectral Data

N-(2-Cyanoethyl)-2-[(3R,4S)-3-ethyl-1-(2-hydroxy-4-methoxybenzyl)-4-piperidinyl]-N-methylacetamide 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 2
No. of Spectra 1547
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 2/5/2020 2:19:05 PM
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Identificators

InChI InChI=1S/C21H31N3O3/c1-4-16-14-24(15-18-6-7-19(27-3)13-20(18)25)11-8-17(16)12-21(26)23(2)10-5-9-22/h6-7,13,16-17,25H,4-5,8,10-12,14-15H2,1-3H3/t16-,17-/m0/s1
InChI Key VALUXOLQBWCVBG-IRXDYDNUSA-N
Canonical SMILES CCC1CN(CCC1CC(=O)N(C)CCC#N)CC2=C(C=C(C=C2)OC)O
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Other Names 4-Piperidineacetamide, N-(2-cyanoethyl)-3-ethyl-1-[(2-hydroxy-4-methoxyphenyl)methyl]-N-methyl-, (3R,4S)-;
NAT14-324056

In Other Databases

ChemSpider 21384345
PubChem 26742624