CID 207482

Brn 0532104

Structural Information

Molecular Formula
C12H21N5
SMILES
CC(C)C1=NC(=NC(=N1)NC2CCCCC2)N
InChI
InChI=1S/C12H21N5/c1-8(2)10-15-11(13)17-12(16-10)14-9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3,(H3,13,14,15,16,17)
InChIKey
LVFZUQXOXDPVOF-UHFFFAOYSA-N
Compound name
2-N-cyclohexyl-6-propan-2-yl-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.1797 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.18698 156.1
[M+Na]+ 258.16892 166.5
[M+NH4]+ 253.21352 163.0
[M+K]+ 274.14286 160.9
[M-H]- 234.17242 159.3
[M+Na-2H]- 256.15437 162.3
[M]+ 235.17915 158.1
[M]- 235.18025 158.1
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.