CID 152134

N-methylolpentamethylmelamine

Structural Information

Molecular Formula
C9H18N6O
SMILES
CN(C)C1=NC(=NC(=N1)N(C)CO)N(C)C
InChI
InChI=1S/C9H18N6O/c1-13(2)7-10-8(14(3)4)12-9(11-7)15(5)6-16/h16H,6H2,1-5H3
InChIKey
GELQGNSEMRPIQJ-UHFFFAOYSA-N
Compound name
[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-methylamino]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

73
Patents

226.1542 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.16148 152.9
[M+Na]+ 249.14342 159.7
[M-H]- 225.14692 155.9
[M+NH4]+ 244.18802 167.8
[M+K]+ 265.11736 160.9
[M+H-H2O]+ 209.15146 143.4
[M+HCOO]- 271.15240 176.9
[M+CH3COO]- 285.16805 206.6
[M+Na-2H]- 247.12887 158.4
[M]+ 226.15365 156.3
[M]- 226.15475 156.3
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