CID 199263

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

Structural Information

Molecular Formula
C7H12N4O
SMILES
CCCC1=NC(=NC(=N1)OC)N
InChI
InChI=1S/C7H12N4O/c1-3-4-5-9-6(8)11-7(10-5)12-2/h3-4H2,1-2H3,(H2,8,9,10,11)
InChIKey
SWXAQMFYWSHBDI-UHFFFAOYSA-N
Compound name
4-methoxy-6-propyl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

168.1011 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.108376 136.6
[M+Na]+ 191.090318 146.0
[M-H]- 167.093824 136.2
[M+NH4]+ 186.134923 153.1
[M+K]+ 207.064258 144.1
[M+H-H2O]+ 151.098360 128.6
[M+HCOO]- 213.099301 158.5
[M+CH3COO]- 227.114951 182.0
[M+Na-2H]- 189.075766 143.8
[M]+ 168.10055142 137.8
[M]- 168.10164858 137.8
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