CID 15166013

1-methyl-1h-pyrazole-3,4-diamine dihydrochloride

Structural Information

Molecular Formula
C4H8N4
SMILES
CN1C=C(C(=N1)N)N
InChI
InChI=1S/C4H8N4/c1-8-2-3(5)4(6)7-8/h2H,5H2,1H3,(H2,6,7)
InChIKey
LOQVLQHJQFWANA-UHFFFAOYSA-N
Compound name
1-methylpyrazole-3,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

80
Patents

112.0749 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 113.08218 119.4
[M+Na]+ 135.06412 129.4
[M+NH4]+ 130.10872 127.0
[M+K]+ 151.03806 127.1
[M-H]- 111.06762 120.5
[M+Na-2H]- 133.04957 124.6
[M]+ 112.07435 120.7
[M]- 112.07545 120.7
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