CID 3080119

1-butanol, 4-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-

Structural Information

Molecular Formula
C14H25N5O2
SMILES
CCCC1=NC(=NC(=N1)N2CCOCC2)NCCCCO
InChI
InChI=1S/C14H25N5O2/c1-2-5-12-16-13(15-6-3-4-9-20)18-14(17-12)19-7-10-21-11-8-19/h20H,2-11H2,1H3,(H,15,16,17,18)
InChIKey
DJKOECUVPZVSPS-UHFFFAOYSA-N
Compound name
4-[(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)amino]butan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.20084 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.20812 173.5
[M+Na]+ 318.19006 183.9
[M+NH4]+ 313.23466 178.3
[M+K]+ 334.16400 178.3
[M-H]- 294.19356 175.6
[M+Na-2H]- 316.17551 177.5
[M]+ 295.20029 175.2
[M]- 295.20139 175.2
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

No patent data available for this compound.