CID 3054723

71680-67-6

Structural Information

Molecular Formula
C7H10N6
SMILES
CC1=NN2C(=C1)N=C(N=C2NC)N
InChI
InChI=1S/C7H10N6/c1-4-3-5-10-6(8)11-7(9-2)13(5)12-4/h3H,1-2H3,(H3,8,9,10,11)
InChIKey
DEAFNROHLSJJBF-UHFFFAOYSA-N
Compound name
4-N,7-dimethylpyrazolo[1,5-a][1,3,5]triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.0967 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.10398 136.7
[M+Na]+ 201.08592 148.7
[M-H]- 177.08942 137.1
[M+NH4]+ 196.13052 154.3
[M+K]+ 217.05986 145.2
[M+H-H2O]+ 161.09396 128.4
[M+HCOO]- 223.09490 160.2
[M+CH3COO]- 237.11055 150.1
[M+Na-2H]- 199.07137 145.2
[M]+ 178.09615 137.9
[M]- 178.09725 137.9
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

No patent data available for this compound.