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]+ 262.16625 183.9
[M+Na]+ 284.14819 190.5
[M-H]- 260.15169 190.0
[M+NH4]+ 279.19279 179.9
[M+K]+ 300.12213 188.2
[M+H-H2O]+ 244.15623 170.0
[M+HCOO]- 306.15717 199.8
[M+CH3COO]- 320.17282 190.2
[M+Na-2H]- 282.13364 184.2
[M]+ 261.15842 193.1
[M]- 261.15952 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.