CID 326489

2,4-diamino-6-diethylamino-1,3,5-triazine

Structural Information

Molecular Formula
C7H14N6
SMILES
CCN(CC)C1=NC(=NC(=N1)N)N
InChI
InChI=1S/C7H14N6/c1-3-13(4-2)7-11-5(8)10-6(9)12-7/h3-4H2,1-2H3,(H4,8,9,10,11,12)
InChIKey
LLOVZIWCKUWRTA-UHFFFAOYSA-N
Compound name
2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

307
Patents

182.12799 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.135266 141.4
[M+Na]+ 205.117208 149.4
[M-H]- 181.120714 142.1
[M+NH4]+ 200.161813 157.0
[M+K]+ 221.091148 147.8
[M+H-H2O]+ 165.125250 132.6
[M+HCOO]- 227.126191 165.0
[M+CH3COO]- 241.141841 192.9
[M+Na-2H]- 203.102656 147.7
[M]+ 182.12744142 140.0
[M]- 182.12853858 140.0
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