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

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

ID: Reference9532

Other Names: 1,3,4-Oxadiazole, 2-(4-methylphenyl)-5-[(3S)-1-[[4-(methylsulfonyl)phenyl]methyl]-3-pyrrolidinyl]-;
NAT31-459559

Formula: C21H23N3O3S

Spectral Data

2-(4-Methylphenyl)-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 1801
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 3/26/2020 5:00:31 PM
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Identificators

InChI InChI=1S/C21H23N3O3S/c1-15-3-7-17(8-4-15)20-22-23-21(27-20)18-11-12-24(14-18)13-16-5-9-19(10-6-16)28(2,25)26/h3-10,18H,11-14H2,1-2H3/t18-/m0/s1
InChI Key UUDPFMKKVLRCJA-SFHVURJKSA-N
Canonical SMILES CC1=CC=C(C=C1)C2=NN=C(O2)C3CCN(C3)CC4=CC=C(C=C4)S(=O)(=O)C
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Other Names 1,3,4-Oxadiazole, 2-(4-methylphenyl)-5-[(3S)-1-[[4-(methylsulfonyl)phenyl]methyl]-3-pyrrolidinyl]-;
NAT31-459559

In Other Databases

PubChem 51137446
ChemSpider 29850448