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

308
Patents

182.12799 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.13527 141.4
[M+Na]+ 205.11721 149.4
[M-H]- 181.12071 142.1
[M+NH4]+ 200.16181 157.0
[M+K]+ 221.09115 147.8
[M+H-H2O]+ 165.12525 132.6
[M+HCOO]- 227.12619 165.0
[M+CH3COO]- 241.14184 192.9
[M+Na-2H]- 203.10266 147.7
[M]+ 182.12744 140.0
[M]- 182.12854 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