2-[(3R,4S)-3-{[5-(Methoxymethyl)-1,2-oxazol-3-yl]methyl}-4-piperidinyl]-1-[4-(2-pyridinyl)-1-piperazinyl]ethanone

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Systematic / IUPAC Name: 2-[(3R,4S)-3-[[5-(Methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone

ID: Reference9459

Other Names: Ethanone, 2-[(3R,4S)-3-[[5-(methoxymethyl)-3-isoxazolyl]methyl]-4-piperidinyl]-1-[4-(2-pyridinyl)-1-piperazinyl]-;
NAT14-350063

Formula: C22H31N5O3

Spectral Data

2-[(3R,4S)-3-{[5-(Methoxymethyl)-1,2-oxazol-3-yl]methyl}-4-piperidinyl]-1-[4-(2-pyridinyl)-1-piperazinyl]ethanone 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 1627
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 3/11/2020 9:38:24 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C22H31N5O3/c1-29-16-20-14-19(25-30-20)12-18-15-23-7-5-17(18)13-22(28)27-10-8-26(9-11-27)21-4-2-3-6-24-21/h2-4,6,14,17-18,23H,5,7-13,15-16H2,1H3/t17-,18-/m0/s1
InChI Key NXDGSYQCTOYBOL-ROUUACIJSA-N
Canonical SMILES COCC1=CC(=NO1)CC2CNCCC2CC(=O)N3CCN(CC3)C4=CC=CC=N4
CAS
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Other Names Ethanone, 2-[(3R,4S)-3-[[5-(methoxymethyl)-3-isoxazolyl]methyl]-4-piperidinyl]-1-[4-(2-pyridinyl)-1-piperazinyl]-;
NAT14-350063

In Other Databases

ChemSpider 21384828
PubChem 26743050