4-{[2-(4-Fluorophenyl)-1-pyrrolidinyl]sulfonyl}-2,1,3-benzoxadiazole

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Systematic / IUPAC Name: 4-{[2-(4-Fluorophenyl)-1-pyrrolidinyl]sulfonyl}-2,1,3-benzoxadiazole

ID: Reference7123

Other Names: 2,1,3-Benzoxadiazole, 4-{[2-(4-fluorophenyl)-1-pyrrolidinyl]sulfonyl}-

Formula: C16H14FN3O3S

Spectral Data

4-{[2-(4-Fluorophenyl)-1-pyrrolidinyl]sulfonyl}-2,1,3-benzoxadiazole 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 1
No. of Spectra 91
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/4/2017 7:15:03 AM
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Identificators

InChI InChI=1S/C16H14FN3O3S/c17-12-8-6-11(7-9-12)14-4-2-10-20(14)24(21,22)15-5-1-3-13-16(15)19-23-18-13/h1,3,5-9,14H,2,4,10H2
InChI Key IDTNUZPGPRAHIY-UHFFFAOYSA-N
Canonical SMILES C1CC(N(C1)S(=O)(=O)C2=CC=CC3=NON=C32)C4=CC=C(C=C4)F
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Other Names 2,1,3-Benzoxadiazole, 4-{[2-(4-fluorophenyl)-1-pyrrolidinyl]sulfonyl}-

In Other Databases

PubChem 2738250
ChemSpider 2019875