N1-(5-Oct-1-ynyl-3-pyridyl)-4-phenylpiperazine-1-carboxamide

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Systematic / IUPAC Name: N-[5-(1-Octyn-1-yl)-3-pyridinyl]-4-phenyl-1-piperazinecarboxamide

ID: Reference4113

Other Names: 1-Piperazinecarboxamide, N-[5-(1-octyn-1-yl)-3-pyridinyl]-4-phenyl-

Formula: C24H30N4O

Spectral Data

N1-(5-Oct-1-ynyl-3-pyridyl)-4-phenylpiperazine-1-carboxamide 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 Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 194
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/9/2016 9:50:20 AM
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Identificators

InChI InChI=1S/C24H30N4O/c1-2-3-4-5-6-8-11-21-18-22(20-25-19-21)26-24(29)28-16-14-27(15-17-28)23-12-9-7-10-13-23/h7,9-10,12-13,18-20H,2-6,14-17H2,1H3,(H,26,29)
InChI Key KWDVQHFWXRWFEU-UHFFFAOYSA-N
Canonical SMILES CCCCCCC#CC1=CC(=CN=C1)NC(=O)N2CCN(CC2)C3=CC=CC=C3
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Other Names 1-Piperazinecarboxamide, N-[5-(1-octyn-1-yl)-3-pyridinyl]-4-phenyl-

In Other Databases

PubChem 2822999
ChemSpider 2101212