(3R,5S)-1-{[5-(Hydroxymethyl)-2-furyl]methyl}-5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-pyrrolidinol

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

ID: Reference12431

Other Names: NAT18-348923

Formula: C19H21N3O4

Spectral Data

(3R,5S)-1-{[5-(Hydroxymethyl)-2-furyl]methyl}-5-[3-(3-methylphenyl)-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 1285
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/6/2023 10:24:52 AM
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Identificators

InChI InChI=1S/C19H21N3O4/c1-12-3-2-4-13(7-12)18-20-19(26-21-18)17-8-14(24)9-22(17)10-15-5-6-16(11-23)25-15/h2-7,14,17,23-24H,8-11H2,1H3/t14-,17+/m1/s1
InChI Key GFCACLADNXYBIU-PBHICJAKSA-N
Canonical SMILES CC1=CC(=CC=C1)C2=NOC(=N2)C3CC(CN3CC4=CC=C(O4)CO)O
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Other Names NAT18-348923

In Other Databases

ChEMBL CHEMBL3436989
PubChem 26743844
ChemSpider 21386305