CID 201842

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

Structural Information

Molecular Formula
C8H14N4O
SMILES
CCC1=NC(=NC(=N1)OCC)NC
InChI
InChI=1S/C8H14N4O/c1-4-6-10-7(9-3)12-8(11-6)13-5-2/h4-5H2,1-3H3,(H,9,10,11,12)
InChIKey
IVIGOAVSYQZAMR-UHFFFAOYSA-N
Compound name
4-ethoxy-6-ethyl-N-methyl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.11676 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.12404 140.6
[M+Na]+ 205.10598 149.6
[M-H]- 181.10948 140.6
[M+NH4]+ 200.15058 156.8
[M+K]+ 221.07992 147.8
[M+H-H2O]+ 165.11402 132.4
[M+HCOO]- 227.11496 162.8
[M+CH3COO]- 241.13061 185.7
[M+Na-2H]- 203.09143 148.4
[M]+ 182.11621 143.2
[M]- 182.11731 143.2
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

patents stripe