1-[2-(2,5-Dimethyl-1H-pyrrol-1-yl)-4-nitrophenyl]-4-(methylsulfonyl)piperazine

enlarge

Systematic / IUPAC Name: 1-[2-(2,5-Dimethylpyrrol-1-yl)-4-nitrophenyl]-4-methylsulfonylpiperazine

ID: Reference8659

Other Names: Piperazine, 1-[2-(2,5-dimethyl-1H-pyrrol-1-yl)-4-nitrophenyl]-4-(methylsulfonyl)-

Formula: C17H22N4O4S

Spectral Data

1-[2-(2,5-Dimethyl-1H-pyrrol-1-yl)-4-nitrophenyl]-4-(methylsulfonyl)piperazine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 109
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/6/2019 12:59:46 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C17H22N4O4S/c1-13-4-5-14(2)20(13)17-12-15(21(22)23)6-7-16(17)18-8-10-19(11-9-18)26(3,24)25/h4-7,12H,8-11H2,1-3H3
InChI Key ALWNPBZKFTVANA-UHFFFAOYSA-N
Canonical SMILES CC1=CC=C(N1C2=C(C=CC(=C2)[N+](=O)[O-])N3CCN(CC3)S(=O)(=O)C)C
CAS
Splash
Other Names Piperazine, 1-[2-(2,5-dimethyl-1H-pyrrol-1-yl)-4-nitrophenyl]-4-(methylsulfonyl)-

In Other Databases

PubChem 2812794
ChemSpider 2091198