CID 3039315

1,3,5-triazine-2,4-diamine, 6-cyclohexyl-n,n,n',n'-tetramethyl-

Structural Information

Molecular Formula
C13H23N5
SMILES
CN(C)C1=NC(=NC(=N1)C2CCCCC2)N(C)C
InChI
InChI=1S/C13H23N5/c1-17(2)12-14-11(10-8-6-5-7-9-10)15-13(16-12)18(3)4/h10H,5-9H2,1-4H3
InChIKey
KNQCWLOWGVWBOZ-UHFFFAOYSA-N
Compound name
6-cyclohexyl-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

249.19534 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.202616 161.1
[M+Na]+ 272.184558 165.6
[M-H]- 248.188064 165.6
[M+NH4]+ 267.229163 174.7
[M+K]+ 288.158498 164.5
[M+H-H2O]+ 232.192600 150.3
[M+HCOO]- 294.193541 180.5
[M+CH3COO]- 308.209191 207.1
[M+Na-2H]- 270.170006 164.8
[M]+ 249.19479142 158.9
[M]- 249.19588858 158.9
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