Systematic / IUPAC Name: (3R,5S)-5-[3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-3-ol
ID: Reference11078
Other Names: NAT18-349462
Formula: C21H23N3O5S
(3R,5S)-5-[3-(4-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[4-(methylsulfonyl)benzyl]-3-pyrrolidinol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 1520 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 11/26/2021 11:07:43 AM |
InChI | InChI=1S/C21H23N3O5S/c1-28-17-7-5-15(6-8-17)20-22-21(29-23-20)19-11-16(25)13-24(19)12-14-3-9-18(10-4-14)30(2,26)27/h3-10,16,19,25H,11-13H2,1-2H3/t16-,19+/m1/s1 |
InChI Key | UCVPHEXFOUJGJT-APWZRJJASA-N |
Canonical SMILES | COC1=CC=C(C=C1)C2=NOC(=N2)C3CC(CN3CC4=CC=C(C=C4)S(=O)(=O)C)O |
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Other Names | NAT18-349462 |