CID 3080162

Urea, n,n-dimethyl-n'-(4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)-

Structural Information

Molecular Formula
C13H22N6O2
SMILES
CCCC1=NC(=NC(=N1)N2CCOCC2)NC(=O)N(C)C
InChI
InChI=1S/C13H22N6O2/c1-4-5-10-14-11(17-13(20)18(2)3)16-12(15-10)19-6-8-21-9-7-19/h4-9H2,1-3H3,(H,14,15,16,17,20)
InChIKey
YEFBYCDRWIBCPG-UHFFFAOYSA-N
Compound name
1,1-dimethyl-3-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

294.18042 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.18770 170.1
[M+Na]+ 317.16964 180.0
[M+NH4]+ 312.21424 174.8
[M+K]+ 333.14358 176.1
[M-H]- 293.17314 173.0
[M+Na-2H]- 315.15509 174.7
[M]+ 294.17987 171.9
[M]- 294.18097 171.9
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