CID 84076076

N-(2-aminoethyl)-1-methyl-1h-pyrazol-3-amine

Structural Information

Molecular Formula
C6H12N4
SMILES
CN1C=CC(=N1)NCCN
InChI
InChI=1S/C6H12N4/c1-10-5-2-6(9-10)8-4-3-7/h2,5H,3-4,7H2,1H3,(H,8,9)
InChIKey
UBMVEIKIZGKSLK-UHFFFAOYSA-N
Compound name
N'-(1-methylpyrazol-3-yl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

140.1062 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.11348 128.4
[M+Na]+ 163.09542 137.8
[M+NH4]+ 158.14002 135.8
[M+K]+ 179.06936 134.6
[M-H]- 139.09892 129.5
[M+Na-2H]- 161.08087 133.8
[M]+ 140.10565 129.6
[M]- 140.10675 129.6
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.