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

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

ID: Reference10198

Other Names: Methanone, [(3S)-3-[5-(ethylsulfonyl)-2-benzoxazolyl]-1-pyrrolidinyl]-2-pyridinyl-;
NAT31-455962

Formula: C19H19N3O4S

Spectral Data

{(3S)-3-[5-(Ethylsulfonyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinyl}(2-pyridinyl)methanone 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 2805
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 1/22/2021 4:27:20 PM
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Identificators

InChI InChI=1S/C19H19N3O4S/c1-2-27(24,25)14-6-7-17-16(11-14)21-18(26-17)13-8-10-22(12-13)19(23)15-5-3-4-9-20-15/h3-7,9,11,13H,2,8,10,12H2,1H3/t13-/m0/s1
InChI Key QQXHDVFYLCEVBU-ZDUSSCGKSA-N
Canonical SMILES CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3CCN(C3)C(=O)C4=CC=CC=N4
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Other Names Methanone, [(3S)-3-[5-(ethylsulfonyl)-2-benzoxazolyl]-1-pyrrolidinyl]-2-pyridinyl-;
NAT31-455962

In Other Databases

ChemSpider 29849878
PubChem 51137032