{(3S)-3-[5-(Ethylsulfonyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinyl}(4-pyridinyl)methanone

enlarge

Systematic / IUPAC Name: [(3S)-3-(5-Ethylsulfonyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]-pyridin-4-ylmethanone

ID: Reference10199

Other Names: Methanone, [(3S)-3-[5-(ethylsulfonyl)-2-benzoxazolyl]-1-pyrrolidinyl]-4-pyridinyl-;
NAT31-455961

Formula: C19H19N3O4S

Spectral Data

{(3S)-3-[5-(Ethylsulfonyl)-1,3-benzoxazol-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.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 2
No. of Spectra 1410
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 1/22/2021 4:28:09 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C19H19N3O4S/c1-2-27(24,25)15-3-4-17-16(11-15)21-18(26-17)14-7-10-22(12-14)19(23)13-5-8-20-9-6-13/h3-6,8-9,11,14H,2,7,10,12H2,1H3/t14-/m0/s1
InChI Key BEWJTAAABOIJKD-AWEZNQCLSA-N
Canonical SMILES CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3CCN(C3)C(=O)C4=CC=NC=C4
CAS
Splash
Other Names Methanone, [(3S)-3-[5-(ethylsulfonyl)-2-benzoxazolyl]-1-pyrrolidinyl]-4-pyridinyl-;
NAT31-455961

In Other Databases

PubChem 51137031
ChemSpider 29849877