CID 19904

2,4-dimethoxy-6-methyl-1,3,5-triazine

Structural Information

Molecular Formula
C6H9N3O2
SMILES
CC1=NC(=NC(=N1)OC)OC
InChI
InChI=1S/C6H9N3O2/c1-4-7-5(10-2)9-6(8-4)11-3/h1-3H3
InChIKey
SSJOYUWBJVZCJV-UHFFFAOYSA-N
Compound name
2,4-dimethoxy-6-methyl-1,3,5-triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

198
Patents

155.06947 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.076746 130.0
[M+Na]+ 178.058688 140.6
[M-H]- 154.062194 130.3
[M+NH4]+ 173.103293 147.5
[M+K]+ 194.032628 140.0
[M+H-H2O]+ 138.066730 122.4
[M+HCOO]- 200.067671 152.0
[M+CH3COO]- 214.083321 176.9
[M+Na-2H]- 176.044136 138.4
[M]+ 155.06892142 134.0
[M]- 155.07001858 134.0
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