CID 3073347

1,3,5-triazin-2-amine, n-cyclopropyl-4-ethyl-6-(4-morpholinyl)-, monohydrochloride

Structural Information

Molecular Formula
C12H19N5O
SMILES
CCC1=NC(=NC(=N1)N2CCOCC2)NC3CC3
InChI
InChI=1S/C12H19N5O/c1-2-10-14-11(13-9-3-4-9)16-12(15-10)17-5-7-18-8-6-17/h9H,2-8H2,1H3,(H,13,14,15,16)
InChIKey
JNRMWLOSJWHEMT-UHFFFAOYSA-N
Compound name
N-cyclopropyl-4-ethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.15897 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.16625 171.3
[M+Na]+ 272.14819 179.0
[M-H]- 248.15169 176.0
[M+NH4]+ 267.19279 176.6
[M+K]+ 288.12213 175.0
[M+H-H2O]+ 232.15623 159.9
[M+HCOO]- 294.15717 187.6
[M+CH3COO]- 308.17282 180.2
[M+Na-2H]- 270.13364 175.9
[M]+ 249.15842 170.3
[M]- 249.15952 170.3
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.