1-{4-[(3S)-3-(5-Fluoro-1H-benzimidazol-2-yl)-1-pyrrolidinyl]-1-piperidinyl}ethanone

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Systematic / IUPAC Name: 1-[4-[(3S)-3-(6-Fluoro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]piperidin-1-yl]ethanone

ID: Reference10312

Other Names: Ethanone, 1-[4-[(3S)-3-(5-fluoro-1H-benzimidazol-2-yl)-1-pyrrolidinyl]-1-piperidinyl]-;
NAT31-457243

Formula: C18H23FN4O

Spectral Data

1-{4-[(3S)-3-(5-Fluoro-1H-benzimidazol-2-yl)-1-pyrrolidinyl]-1-piperidinyl}ethanone 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 3940
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 3/19/2021 2:05:53 PM
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Identificators

InChI InChI=1S/C18H23FN4O/c1-12(24)22-8-5-15(6-9-22)23-7-4-13(11-23)18-20-16-3-2-14(19)10-17(16)21-18/h2-3,10,13,15H,4-9,11H2,1H3,(H,20,21)/t13-/m0/s1
InChI Key IQONYVVHHNSXQD-ZDUSSCGKSA-N
Canonical SMILES CC(=O)N1CCC(CC1)N2CCC(C2)C3=NC4=C(N3)C=C(C=C4)F
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Other Names Ethanone, 1-[4-[(3S)-3-(5-fluoro-1H-benzimidazol-2-yl)-1-pyrrolidinyl]-1-piperidinyl]-;
NAT31-457243

In Other Databases

PubChem 45784243
ChemSpider 29850042