CID 199901

4-ethyl-6-methoxy-n-methyl-1,3,5-triazin-2-amine

Structural Information

Molecular Formula
C7H12N4O
SMILES
CCC1=NC(=NC(=N1)OC)NC
InChI
InChI=1S/C7H12N4O/c1-4-5-9-6(8-2)11-7(10-5)12-3/h4H2,1-3H3,(H,8,9,10,11)
InChIKey
AVVSATZLIRMRDX-UHFFFAOYSA-N
Compound name
4-ethyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

168.1011 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.10838 136.2
[M+Na]+ 191.09032 145.6
[M-H]- 167.09382 136.2
[M+NH4]+ 186.13492 152.9
[M+K]+ 207.06426 144.0
[M+H-H2O]+ 151.09836 128.1
[M+HCOO]- 213.09930 158.6
[M+CH3COO]- 227.11495 182.7
[M+Na-2H]- 189.07577 144.4
[M]+ 168.10055 138.3
[M]- 168.10165 138.3
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