CID 48861

Brn 0573922

Structural Information

Molecular Formula
C15H24N6O2
SMILES
CCN(C1COC(OC1)(C)C)C2=NC(=NC(=N2)N3CC3)N4CC4
InChI
InChI=1S/C15H24N6O2/c1-4-21(11-9-22-15(2,3)23-10-11)14-17-12(19-5-6-19)16-13(18-14)20-7-8-20/h11H,4-10H2,1-3H3
InChIKey
GULJYHBRVJLEMJ-UHFFFAOYSA-N
Compound name
4,6-bis(aziridin-1-yl)-N-(2,2-dimethyl-1,3-dioxan-5-yl)-N-ethyl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.19608 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.20336 210.7
[M+Na]+ 343.18530 217.6
[M-H]- 319.18880 217.9
[M+NH4]+ 338.22990 208.0
[M+K]+ 359.15924 216.7
[M+H-H2O]+ 303.19334 200.0
[M+HCOO]- 365.19428 221.7
[M+CH3COO]- 379.20993 215.8
[M+Na-2H]- 341.17075 209.9
[M]+ 320.19553 214.4
[M]- 320.19663 214.4
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.