CID 21623

Melamine, n2,n4,n6-triisopropyl-

Structural Information

Molecular Formula
C12H24N6
SMILES
CC(C)NC1=NC(=NC(=N1)NC(C)C)NC(C)C
InChI
InChI=1S/C12H24N6/c1-7(2)13-10-16-11(14-8(3)4)18-12(17-10)15-9(5)6/h7-9H,1-6H3,(H3,13,14,15,16,17,18)
InChIKey
VHYSDRYXGKFTPY-UHFFFAOYSA-N
Compound name
2-N,4-N,6-N-tri(propan-2-yl)-1,3,5-triazine-2,4,6-triamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

32
Patents

252.20624 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.213516 164.4
[M+Na]+ 275.195458 169.3
[M-H]- 251.198964 164.2
[M+NH4]+ 270.240063 176.9
[M+K]+ 291.169398 167.5
[M+H-H2O]+ 235.203500 155.2
[M+HCOO]- 297.204441 184.2
[M+CH3COO]- 311.220091 208.5
[M+Na-2H]- 273.180906 167.4
[M]+ 252.20569142 163.7
[M]- 252.20678858 163.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe