[(3S)-3-(5-Methyl-1,3-benzoxazol-2-yl)-1-pyrrolidinyl](3-pyridinyl)methanone

Systematic / IUPAC Name: [(3S)-3-(5-Methyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]-pyridin-3-ylmethanone

ID: Reference11151

Other Names: NAT31-453677

Formula: C18H17N3O2

Spectral Data

[(3S)-3-(5-Methyl-1,3-benzoxazol-2-yl)-1-pyrrolidinyl](3-pyridinyl)methanone 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 Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1020
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 1/20/2022 2:55:09 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C18H17N3O2/c1-12-4-5-16-15(9-12)20-17(23-16)14-6-8-21(11-14)18(22)13-3-2-7-19-10-13/h2-5,7,9-10,14H,6,8,11H2,1H3/t14-/m0/s1
InChI Key URYQCDZFRGFOPL-AWEZNQCLSA-N
Canonical SMILES CC1=CC2=C(C=C1)OC(=N2)C3CCN(C3)C(=O)C4=CN=CC=C4
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Other Names NAT31-453677

In Other Databases

PubChem 45783955
ChemSpider 29849795