2-(2-Methoxyphenyl)-5-{(3S)-1-[4-(methylsulfonyl)benzyl]-3-pyrrolidinyl}-1,3,4-oxadiazole

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Systematic / IUPAC Name: 2-(2-Methoxyphenyl)-5-[(3S)-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-3-yl]-1,3,4-oxadiazole

ID: Reference9542

Other Names: 1,3,4-Oxadiazole, 2-(2-methoxyphenyl)-5-[(3S)-1-[[4-(methylsulfonyl)phenyl]methyl]-3-pyrrolidinyl]-;
NAT31-459618

Formula: C21H23N3O4S

Spectral Data

2-(2-Methoxyphenyl)-5-{(3S)-1-[4-(methylsulfonyl)benzyl]-3-pyrrolidinyl}-1,3,4-oxadiazole 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 1
No. of Spectra 2324
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 4/1/2020 7:27:32 AM
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Identificators

InChI InChI=1S/C21H23N3O4S/c1-27-19-6-4-3-5-18(19)21-23-22-20(28-21)16-11-12-24(14-16)13-15-7-9-17(10-8-15)29(2,25)26/h3-10,16H,11-14H2,1-2H3/t16-/m0/s1
InChI Key WKGBDVDBQYYRLF-INIZCTEOSA-N
Canonical SMILES COC1=CC=CC=C1C2=NN=C(O2)C3CCN(C3)CC4=CC=C(C=C4)S(=O)(=O)C
CAS
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Other Names 1,3,4-Oxadiazole, 2-(2-methoxyphenyl)-5-[(3S)-1-[[4-(methylsulfonyl)phenyl]methyl]-3-pyrrolidinyl]-;
NAT31-459618

In Other Databases

PubChem 51137482
ChemSpider 29850482