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

enlarge

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

ID: Reference9538

Other Names: 1,3,4-Oxadiazole, 2-(4-methoxyphenyl)-5-[(3S)-1-[[4-(methylsulfonyl)phenyl]methyl]-3-pyrrolidinyl]-;
NAT31-459677

Formula: C21H23N3O4S

Spectral Data

2-(4-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.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1130
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 4/1/2020 7:16:18 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C21H23N3O4S/c1-27-18-7-5-16(6-8-18)20-22-23-21(28-20)17-11-12-24(14-17)13-15-3-9-19(10-4-15)29(2,25)26/h3-10,17H,11-14H2,1-2H3/t17-/m0/s1
InChI Key HCSNPYLXBMITSH-KRWDZBQOSA-N
Canonical SMILES COC1=CC=C(C=C1)C2=NN=C(O2)C3CCN(C3)CC4=CC=C(C=C4)S(=O)(=O)C
CAS
Splash
Other Names 1,3,4-Oxadiazole, 2-(4-methoxyphenyl)-5-[(3S)-1-[[4-(methylsulfonyl)phenyl]methyl]-3-pyrrolidinyl]-;
NAT31-459677

In Other Databases

PubChem 51137517
ChemSpider 29850510