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

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

ID: Reference9587

Other Names: 4-Pyrimidinamine, 5-[5-[(2S)-1-(1H-imidazol-2-ylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-;
NAT18-473416

Formula: C14H16N8O

Spectral Data

5-{5-[(2S)-1-(1H-Imidazol-2-ylmethyl)-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 2
No. of Spectra 2232
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 4/9/2020 5:41:16 AM
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Identificators

InChI InChI=1S/C14H16N8O/c15-12-9(6-16-8-19-12)13-20-14(23-21-13)10-2-1-5-22(10)7-11-17-3-4-18-11/h3-4,6,8,10H,1-2,5,7H2,(H,17,18)(H2,15,16,19)/t10-/m0/s1
InChI Key SOBAMWGGNDVGPF-JTQLQIEISA-N
Canonical SMILES C1CC(N(C1)CC2=NC=CN2)C3=NC(=NO3)C4=CN=CN=C4N
CAS
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Other Names 4-Pyrimidinamine, 5-[5-[(2S)-1-(1H-imidazol-2-ylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-;
NAT18-473416

In Other Databases

ChemSpider 29858223
PubChem 45783753