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
3-N-ethyl-2,5-dimethylpyrazole-3,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

154.12184 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.12912 133.5
[M+Na]+ 177.11106 142.8
[M-H]- 153.11456 134.9
[M+NH4]+ 172.15566 153.7
[M+K]+ 193.08500 140.9
[M+H-H2O]+ 137.11910 126.5
[M+HCOO]- 199.12004 158.2
[M+CH3COO]- 213.13569 183.3
[M+Na-2H]- 175.09651 137.9
[M]+ 154.12129 133.0
[M]- 154.12239 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