CID 20067384

Trimmm

Structural Information

Molecular Formula
C9H18N6O3
SMILES
COCNC1=NC(=NC(=N1)N)N(COC)COC
InChI
InChI=1S/C9H18N6O3/c1-16-4-11-8-12-7(10)13-9(14-8)15(5-17-2)6-18-3/h4-6H2,1-3H3,(H3,10,11,12,13,14)
InChIKey
QRUPLLGJMSYASL-UHFFFAOYSA-N
Compound name
2-N,2-N,4-N-tris(methoxymethyl)-1,3,5-triazine-2,4,6-triamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

151
Patents

258.14404 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.15132 156.6
[M+Na]+ 281.13326 165.0
[M+NH4]+ 276.17786 160.9
[M+K]+ 297.10720 161.9
[M-H]- 257.13676 156.7
[M+Na-2H]- 279.11871 160.9
[M]+ 258.14349 157.2
[M]- 258.14459 157.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe