CID 199954

Brn 0535974

Structural Information

Molecular Formula
C9H15N5O2
SMILES
COC1=NC(=NC(=N1)N)CN2CCOCC2
InChI
InChI=1S/C9H15N5O2/c1-15-9-12-7(11-8(10)13-9)6-14-2-4-16-5-3-14/h2-6H2,1H3,(H2,10,11,12,13)
InChIKey
XLMLORYWJCIRJA-UHFFFAOYSA-N
Compound name
4-methoxy-6-(morpholin-4-ylmethyl)-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.12257 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.12985 152.9
[M+Na]+ 248.11179 159.7
[M-H]- 224.11529 153.8
[M+NH4]+ 243.15639 163.4
[M+K]+ 264.08573 158.0
[M+H-H2O]+ 208.11983 142.3
[M+HCOO]- 270.12077 169.0
[M+CH3COO]- 284.13642 190.0
[M+Na-2H]- 246.09724 158.9
[M]+ 225.12202 150.4
[M]- 225.12312 150.4
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

No patent data available for this compound.