CID 3073370

148312-46-3

Structural Information

Molecular Formula
C13H19N5O
SMILES
COC1CN(C1)C2=NC(=NC(=N2)NC3CC3)C4CC4
InChI
InChI=1S/C13H19N5O/c1-19-10-6-18(7-10)13-16-11(8-2-3-8)15-12(17-13)14-9-4-5-9/h8-10H,2-7H2,1H3,(H,14,15,16,17)
InChIKey
DEZUSWBHWQDROZ-UHFFFAOYSA-N
Compound name
N,4-dicyclopropyl-6-(3-methoxyazetidin-1-yl)-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.15897 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.166246 183.9
[M+Na]+ 284.148188 190.5
[M-H]- 260.151694 190.0
[M+NH4]+ 279.192793 179.9
[M+K]+ 300.122128 188.2
[M+H-H2O]+ 244.156230 170.0
[M+HCOO]- 306.157171 199.8
[M+CH3COO]- 320.172821 190.2
[M+Na-2H]- 282.133636 184.2
[M]+ 261.15842142 193.1
[M]- 261.15951858 193.1
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.