CID 207460

30072-60-7

Structural Information

Molecular Formula
C17H30N6
SMILES
CC1CCCC(C1)NC2=NC(=NC(=N2)N)NC3CCCC(C3)C
InChI
InChI=1S/C17H30N6/c1-11-5-3-7-13(9-11)19-16-21-15(18)22-17(23-16)20-14-8-4-6-12(2)10-14/h11-14H,3-10H2,1-2H3,(H4,18,19,20,21,22,23)
InChIKey
HKPREASVBSQVCP-UHFFFAOYSA-N
Compound name
2-N,4-N-bis(3-methylcyclohexyl)-1,3,5-triazine-2,4,6-triamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.2532 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.26048 180.1
[M+Na]+ 341.24242 182.0
[M-H]- 317.24592 183.7
[M+NH4]+ 336.28702 188.8
[M+K]+ 357.21636 176.7
[M+H-H2O]+ 301.25046 168.4
[M+HCOO]- 363.25140 194.6
[M+CH3COO]- 377.26705 186.9
[M+Na-2H]- 339.22787 181.0
[M]+ 318.25265 169.4
[M]- 318.25375 169.4
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.