CID 119031227

(3r,4s)-n-methyl-4-(1-methyl-1h-pyrazol-4-yl)pyrrolidine-3-carboxamide

Structural Information

Molecular Formula
C10H16N4O
SMILES
CNC(=O)[C@H]1CNC[C@@H]1C2=CN(N=C2)C
InChI
InChI=1S/C10H16N4O/c1-11-10(15)9-5-12-4-8(9)7-3-13-14(2)6-7/h3,6,8-9,12H,4-5H2,1-2H3,(H,11,15)/t8-,9+/m1/s1
InChIKey
NWQNWBGNKHNAGL-BDAKNGLRSA-N
Compound name
(3R,4S)-N-methyl-4-(1-methylpyrazol-4-yl)pyrrolidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

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References

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Patents

208.13242 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.13970 148.1
[M+Na]+ 231.12164 156.3
[M+NH4]+ 226.16624 154.3
[M+K]+ 247.09558 155.9
[M-H]- 207.12514 148.4
[M+Na-2H]- 229.10709 151.7
[M]+ 208.13187 148.8
[M]- 208.13297 148.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.