Systematic / IUPAC Name: [(3S)-3-(6-Methyl-1H-benzimidazol-2-yl)pyrrolidin-1-yl]-pyridin-4-ylmethanone
ID: Reference8804
Other Names:
Methanone, [(3S)-3-(5-methyl-1H-benzimidazol-2-yl)-1-pyrrolidinyl]-4-pyridinyl-;
NAT31-454377
Formula: C18H18N4O
[(3S)-3-(5-Methyl-1H-benzimidazol-2-yl)-1-pyrrolidinyl](4-pyridinyl)methanone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
No. of Spectral Trees | 2 |
No. of Spectra | 1519 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 7/29/2019 11:14:58 AM |
InChI | InChI=1S/C18H18N4O/c1-12-2-3-15-16(10-12)21-17(20-15)14-6-9-22(11-14)18(23)13-4-7-19-8-5-13/h2-5,7-8,10,14H,6,9,11H2,1H3,(H,20,21)/t14-/m0/s1 |
InChI Key | PWVHCKHUQPBRTI-AWEZNQCLSA-N |
Canonical SMILES | CC1=CC2=C(C=C1)N=C(N2)C3CCN(C3)C(=O)C4=CC=NC=C4 |
CAS | |
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Other Names |
Methanone, [(3S)-3-(5-methyl-1H-benzimidazol-2-yl)-1-pyrrolidinyl]-4-pyridinyl-; NAT31-454377 |