CID 75480575

4-(aminomethyl)-1-methyl-1h-pyrazol-3-amine

Structural Information

Molecular Formula
C5H10N4
SMILES
CN1C=C(C(=N1)N)CN
InChI
InChI=1S/C5H10N4/c1-9-3-4(2-6)5(7)8-9/h3H,2,6H2,1H3,(H2,7,8)
InChIKey
KJPISRZKUHMHMC-UHFFFAOYSA-N
Compound name
4-(aminomethyl)-1-methylpyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

126.090546 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.097822 124.3
[M+Na]+ 149.079764 133.6
[M-H]- 125.083270 125.2
[M+NH4]+ 144.124369 145.1
[M+K]+ 165.053704 131.9
[M+H-H2O]+ 109.087806 117.4
[M+HCOO]- 171.088747 149.1
[M+CH3COO]- 185.104397 175.4
[M+Na-2H]- 147.065212 129.5
[M]+ 126.08999742 121.8
[M]- 126.09109458 121.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe