5-(Ethylsulfonyl)-2-[(3S)-1-(4-fluorobenzyl)-3-pyrrolidinyl]-1,3-benzoxazole

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Systematic / IUPAC Name: 5-Ethylsulfonyl-2-[(3S)-1-[(4-fluorophenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole

ID: Reference9694

Other Names: Benzoxazole, 5-(ethylsulfonyl)-2-[(3S)-1-[(4-fluorophenyl)methyl]-3-pyrrolidinyl]-;
NAT31-458092

Formula: C20H21FN2O3S

Spectral Data

5-(Ethylsulfonyl)-2-[(3S)-1-(4-fluorobenzyl)-3-pyrrolidinyl]-1,3-benzoxazole 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 3272
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers FT
Last Modification 5/15/2020 10:14:25 AM
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Identificators

InChI InChI=1S/C20H21FN2O3S/c1-2-27(24,25)17-7-8-19-18(11-17)22-20(26-19)15-9-10-23(13-15)12-14-3-5-16(21)6-4-14/h3-8,11,15H,2,9-10,12-13H2,1H3/t15-/m0/s1
InChI Key SVTSSKZBQAINEI-HNNXBMFYSA-N
Canonical SMILES CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3CCN(C3)CC4=CC=C(C=C4)F
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Other Names Benzoxazole, 5-(ethylsulfonyl)-2-[(3S)-1-[(4-fluorophenyl)methyl]-3-pyrrolidinyl]-;
NAT31-458092

In Other Databases

ChemSpider 29850156
PubChem 51137136