2-[(3S)-1-(1,3-Benzodioxol-5-ylmethyl)-3-pyrrolidinyl]-5-fluoro-1H-benzimidazole

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Systematic / IUPAC Name: 2-[(3S)-1-(1,3-Benzodioxol-5-ylmethyl)pyrrolidin-3-yl]-6-fluoro-1H-benzimidazole

ID: Reference8829

Other Names: 1H-Benzimidazole, 2-[(3S)-1-(1,3-benzodioxol-5-ylmethyl)-3-pyrrolidinyl]-5-fluoro-;
NAT31-457221

Formula: C19H18FN3O2

Spectral Data

2-[(3S)-1-(1,3-Benzodioxol-5-ylmethyl)-3-pyrrolidinyl]-5-fluoro-1H-benzimidazole 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 FAIMS
No. of Spectral Trees 2
No. of Spectra 2059
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/2/2024 7:31:48 AM
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Identificators

InChI InChI=1S/C19H18FN3O2/c20-14-2-3-15-16(8-14)22-19(21-15)13-5-6-23(10-13)9-12-1-4-17-18(7-12)25-11-24-17/h1-4,7-8,13H,5-6,9-11H2,(H,21,22)/t13-/m0/s1
InChI Key GTBXBMOUSKGGFW-ZDUSSCGKSA-N
Canonical SMILES C1CN(CC1C2=NC3=C(N2)C=C(C=C3)F)CC4=CC5=C(C=C4)OCO5
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Other Names 1H-Benzimidazole, 2-[(3S)-1-(1,3-benzodioxol-5-ylmethyl)-3-pyrrolidinyl]-5-fluoro-;
NAT31-457221

In Other Databases

ChemSpider 29850031
PubChem 45784235