(3R,5S)-5-(3-Cyclopropyl-1,2,4-oxadiazol-5-yl)-1-[4-(methylsulfonyl)benzyl]-3-pyrrolidinol

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Systematic / IUPAC Name: (3R,5S)-5-(3-Cyclopropyl-1,2,4-oxadiazol-5-yl)-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-3-ol

ID: Reference10885

Other Names: 3-Pyrrolidinol, 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-[[4-(methylsulfonyl)phenyl]methyl]-, (3R,5S)-;
NAT18-349630

Formula: C17H21N3O4S

Spectral Data

(3R,5S)-5-(3-Cyclopropyl-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.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 915
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 9/23/2021 10:31:46 AM
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Identificators

InChI InChI=1S/C17H21N3O4S/c1-25(22,23)14-6-2-11(3-7-14)9-20-10-13(21)8-15(20)17-18-16(19-24-17)12-4-5-12/h2-3,6-7,12-13,15,21H,4-5,8-10H2,1H3/t13-,15+/m1/s1
InChI Key XFADFUYFANTQBH-HIFRSBDPSA-N
Canonical SMILES CS(=O)(=O)C1=CC=C(C=C1)CN2CC(CC2C3=NC(=NO3)C4CC4)O
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Other Names 3-Pyrrolidinol, 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-[[4-(methylsulfonyl)phenyl]methyl]-, (3R,5S)-;
NAT18-349630

In Other Databases

ChemSpider 21386521
PubChem 26744288