CID 199905

N-ethyl-4-methoxy-6-propyl-1,3,5-triazin-2-amine

Structural Information

Molecular Formula
C9H16N4O
SMILES
CCCC1=NC(=NC(=N1)OC)NCC
InChI
InChI=1S/C9H16N4O/c1-4-6-7-11-8(10-5-2)13-9(12-7)14-3/h4-6H2,1-3H3,(H,10,11,12,13)
InChIKey
NJDIKYNNCCYNDN-UHFFFAOYSA-N
Compound name
N-ethyl-4-methoxy-6-propyl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

196.13242 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.139696 145.1
[M+Na]+ 219.121638 153.6
[M-H]- 195.125144 144.9
[M+NH4]+ 214.166243 160.7
[M+K]+ 235.095578 151.6
[M+H-H2O]+ 179.129680 136.6
[M+HCOO]- 241.130621 166.9
[M+CH3COO]- 255.146271 188.7
[M+Na-2H]- 217.107086 152.3
[M]+ 196.13187142 148.0
[M]- 196.13296858 148.0
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