CID 3080140

Acetamide, n-methyl-n-(4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)-

Structural Information

Molecular Formula
C13H21N5O2
SMILES
CCCC1=NC(=NC(=N1)N(C)C(=O)C)N2CCOCC2
InChI
InChI=1S/C13H21N5O2/c1-4-5-11-14-12(17(3)10(2)19)16-13(15-11)18-6-8-20-9-7-18/h4-9H2,1-3H3
InChIKey
OLCZQKCJFOMGKC-UHFFFAOYSA-N
Compound name
N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.16953 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.176806 169.0
[M+Na]+ 302.158748 174.3
[M-H]- 278.162254 171.4
[M+NH4]+ 297.203353 178.1
[M+K]+ 318.132688 173.3
[M+H-H2O]+ 262.166790 157.7
[M+HCOO]- 324.167731 184.1
[M+CH3COO]- 338.183381 205.3
[M+Na-2H]- 300.144196 172.2
[M]+ 279.16898142 168.7
[M]- 279.17007858 168.7
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.