CID 3080168

1,3,5-triazin-2-amine, n-methyl-4-(4-morpholinyl)-6-propyl-, monohydrochloride

Structural Information

Molecular Formula
C11H19N5O
SMILES
CCCC1=NC(=NC(=N1)N2CCOCC2)NC
InChI
InChI=1S/C11H19N5O/c1-3-4-9-13-10(12-2)15-11(14-9)16-5-7-17-8-6-16/h3-8H2,1-2H3,(H,12,13,14,15)
InChIKey
DEEJUOIMQOMMJA-UHFFFAOYSA-N
Compound name
N-methyl-4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

237.15897 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.16625 158.8
[M+Na]+ 260.14819 164.8
[M-H]- 236.15169 159.8
[M+NH4]+ 255.19279 169.2
[M+K]+ 276.12213 162.5
[M+H-H2O]+ 220.15623 147.9
[M+HCOO]- 282.15717 174.6
[M+CH3COO]- 296.17282 194.4
[M+Na-2H]- 258.13364 164.7
[M]+ 237.15842 156.5
[M]- 237.15952 156.5
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