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

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

ID: Reference9469

Other Names: Ethanone, 2-[(3R,4S)-3-[(5-butyl-3-isoxazolyl)methyl]-4-piperidinyl]-1-(4-phenyl-1-piperazinyl)-;
NAT14-350012

Formula: C25H36N4O2

Spectral Data

2-{(3R,4S)-3-[(5-Butyl-1,2-oxazol-3-yl)methyl]-4-piperidinyl}-1-(4-phenyl-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 1089
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 3/11/2020 10:20:27 AM
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Identificators

InChI InChI=1S/C25H36N4O2/c1-2-3-9-24-18-22(27-31-24)16-21-19-26-11-10-20(21)17-25(30)29-14-12-28(13-15-29)23-7-5-4-6-8-23/h4-8,18,20-21,26H,2-3,9-17,19H2,1H3/t20-,21-/m0/s1
InChI Key KZKWCWIJZHZMTC-SFTDATJTSA-N
Canonical SMILES CCCCC1=CC(=NO1)CC2CNCCC2CC(=O)N3CCN(CC3)C4=CC=CC=C4
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Other Names Ethanone, 2-[(3R,4S)-3-[(5-butyl-3-isoxazolyl)methyl]-4-piperidinyl]-1-(4-phenyl-1-piperazinyl)-;
NAT14-350012

In Other Databases

ChemSpider 21384798
PubChem 26742987