CID 43554024

N5-ethyl-1,3-dimethyl-1h-pyrazole-4,5-diamine hydrochloride

Structural Information

Molecular Formula
C7H14N4
SMILES
CCNC1=C(C(=NN1C)C)N
InChI
InChI=1S/C7H14N4/c1-4-9-7-6(8)5(2)10-11(7)3/h9H,4,8H2,1-3H3
InChIKey
GKERKLLAMVQMOK-UHFFFAOYSA-N
Compound name
5-N-ethyl-1,3-dimethylpyrazole-4,5-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

154.12184 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.129116 133.5
[M+Na]+ 177.111058 142.8
[M-H]- 153.114564 134.9
[M+NH4]+ 172.155663 153.7
[M+K]+ 193.084998 140.9
[M+H-H2O]+ 137.119100 126.5
[M+HCOO]- 199.120041 158.2
[M+CH3COO]- 213.135691 183.3
[M+Na-2H]- 175.096506 137.9
[M]+ 154.12129142 133.0
[M]- 154.12238858 133.0
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