{(3R,4S)-1-(4-Fluorobenzoyl)-3-[2-(4-phenyl-1-piperazinyl)ethyl]-4-piperidinyl}acetic acid

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Systematic / IUPAC Name: 2-[(3R,4S)-1-(4-Fluorobenzoyl)-3-[2-(4-phenylpiperazin-1-yl)ethyl]piperidin-4-yl]acetic acid

ID: Reference9475

Other Names: 4-Piperidineacetic acid, 1-(4-fluorobenzoyl)-3-[2-(4-phenyl-1-piperazinyl)ethyl]-, (3R,4S)-;
NAT14-336306

Formula: C26H32FN3O3

Spectral Data

{(3R,4S)-1-(4-Fluorobenzoyl)-3-[2-(4-phenyl-1-piperazinyl)ethyl]-4-piperidinyl}acetic acid 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 1554
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 3/12/2020 8:47:50 AM
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Identificators

InChI InChI=1S/C26H32FN3O3/c27-23-8-6-20(7-9-23)26(33)30-13-11-21(18-25(31)32)22(19-30)10-12-28-14-16-29(17-15-28)24-4-2-1-3-5-24/h1-9,21-22H,10-19H2,(H,31,32)/t21-,22-/m0/s1
InChI Key SBPQZXNVYOLRKW-VXKWHMMOSA-N
Canonical SMILES C1CN(CC(C1CC(=O)O)CCN2CCN(CC2)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)F
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Other Names 4-Piperidineacetic acid, 1-(4-fluorobenzoyl)-3-[2-(4-phenyl-1-piperazinyl)ethyl]-, (3R,4S)-;
NAT14-336306

In Other Databases

ChemSpider 21384472
PubChem 25313130