5-{5-[(2S)-1-(3-Phenylpropyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl}-4-pyrimidinamine

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Systematic / IUPAC Name: 5-[5-[(2S)-1-(3-Phenylpropyl)pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyrimidin-4-amine

ID: Reference12227

Other Names: NAT18-473390

Formula: C19H22N6O

Spectral Data

5-{5-[(2S)-1-(3-Phenylpropyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl}-4-pyrimidinamine 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 320
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 2/9/2023 8:51:11 PM
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Identificators

InChI InChI=1S/C19H22N6O/c20-17-15(12-21-13-22-17)18-23-19(26-24-18)16-9-5-11-25(16)10-4-8-14-6-2-1-3-7-14/h1-3,6-7,12-13,16H,4-5,8-11H2,(H2,20,21,22)/t16-/m0/s1
InChI Key ZVUPITLMFKKQAT-INIZCTEOSA-N
Canonical SMILES C1CC(N(C1)CCCC2=CC=CC=C2)C3=NC(=NO3)C4=CN=CN=C4N
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Other Names NAT18-473390

In Other Databases

ChemSpider 29858209
PubChem 45783736
ChEMBL CHEMBL3436985