CID 3073368

Ethanol, 2,2'-((4-(cyclopropyl-6-(cyclorpopylamino)-1,3,5-triazin-2-yl)imino)bis-

Structural Information

Molecular Formula
C13H21N5O2
SMILES
C1CC1C2=NC(=NC(=N2)N(CCO)CCO)NC3CC3
InChI
InChI=1S/C13H21N5O2/c19-7-5-18(6-8-20)13-16-11(9-1-2-9)15-12(17-13)14-10-3-4-10/h9-10,19-20H,1-8H2,(H,14,15,16,17)
InChIKey
IXEFVJANBSCXDS-UHFFFAOYSA-N
Compound name
2-[[4-cyclopropyl-6-(cyclopropylamino)-1,3,5-triazin-2-yl]-(2-hydroxyethyl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.16953 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.17681 142.7
[M+Na]+ 302.15875 153.8
[M+NH4]+ 297.20335 149.0
[M+K]+ 318.13269 153.5
[M-H]- 278.16225 156.9
[M+Na-2H]- 300.14420 153.8
[M]+ 279.16898 149.9
[M]- 279.17008 149.9
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

No patent data available for this compound.