(3R,5S)-1-(Tetrahydro-2H-pyran-4-yl)-5-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}-3-pyrrolidinol

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Systematic / IUPAC Name: (3R,5S)-1-(Oxan-4-yl)-5-[3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-3-ol

ID: Reference9378

Other Names: 3-Pyrrolidinol, 1-(tetrahydro-2H-pyran-4-yl)-5-[3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]-, (3R,5S)-;
NAT18-348548

Formula: C18H20F3N3O3

Spectral Data

(3R,5S)-1-(Tetrahydro-2H-pyran-4-yl)-5-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}-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 709
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 2/17/2020 8:22:41 AM
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Identificators

InChI InChI=1S/C18H20F3N3O3/c19-18(20,21)12-3-1-11(2-4-12)16-22-17(27-23-16)15-9-14(25)10-24(15)13-5-7-26-8-6-13/h1-4,13-15,25H,5-10H2/t14-,15+/m1/s1
InChI Key FWZAVDMBNOPIHX-CABCVRRESA-N
Canonical SMILES C1COCCC1N2CC(CC2C3=NC(=NO3)C4=CC=C(C=C4)C(F)(F)F)O
CAS
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Other Names 3-Pyrrolidinol, 1-(tetrahydro-2H-pyran-4-yl)-5-[3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]-, (3R,5S)-;
NAT18-348548

In Other Databases

ChemSpider 21386201
PubChem 26743636