(2S)-4-(3-Fluorobenzoyl)-N-[(3S)-2-oxo-3-piperidinyl]-1-(4-piperidinylcarbonyl)-2-piperazinecarboxamide

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Systematic / IUPAC Name: (2S)-4-(3-Fluorobenzoyl)-N-[(3S)-2-oxopiperidin-3-yl]-1-(piperidine-4-carbonyl)piperazine-2-carboxamide

ID: Reference9308

Other Names: 2-Piperazinecarboxamide, 4-(3-fluorobenzoyl)-N-[(3S)-2-oxo-3-piperidinyl]-1-(4-piperidinylcarbonyl)-, (2S)-;
NAT9-323014

Formula: C23H30FN5O4

Spectral Data

(2S)-4-(3-Fluorobenzoyl)-N-[(3S)-2-oxo-3-piperidinyl]-1-(4-piperidinylcarbonyl)-2-piperazinecarboxamide 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 4302
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 1/23/2020 2:11:11 PM
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Identificators

InChI InChI=1S/C23H30FN5O4/c24-17-4-1-3-16(13-17)22(32)28-11-12-29(23(33)15-6-9-25-10-7-15)19(14-28)21(31)27-18-5-2-8-26-20(18)30/h1,3-4,13,15,18-19,25H,2,5-12,14H2,(H,26,30)(H,27,31)/t18-,19-/m0/s1
InChI Key PBLPXZUWQDVCAI-OALUTQOASA-N
Canonical SMILES C1CC(C(=O)NC1)NC(=O)C2CN(CCN2C(=O)C3CCNCC3)C(=O)C4=CC(=CC=C4)F
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Other Names 2-Piperazinecarboxamide, 4-(3-fluorobenzoyl)-N-[(3S)-2-oxo-3-piperidinyl]-1-(4-piperidinylcarbonyl)-, (2S)-;
NAT9-323014

In Other Databases

ChemSpider 7707628
PubChem 9423851