CID 3073375

1,3,5-triazin-2-amine, n,4-dicyclopropyl-6-(4-thiomorpholinyl)-, s-oxide

Structural Information

Molecular Formula
C13H19N5OS
SMILES
C1CC1C2=NC(=NC(=N2)N3CCS(=O)CC3)NC4CC4
InChI
InChI=1S/C13H19N5OS/c19-20-7-5-18(6-8-20)13-16-11(9-1-2-9)15-12(17-13)14-10-3-4-10/h9-10H,1-8H2,(H,14,15,16,17)
InChIKey
YDFWTOCGFAXHHU-UHFFFAOYSA-N
Compound name
N,4-dicyclopropyl-6-(1-oxo-1,4-thiazinan-4-yl)-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

293.13104 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.13832 148.0
[M+Na]+ 316.12026 161.1
[M+NH4]+ 311.16486 155.7
[M+K]+ 332.09420 157.6
[M-H]- 292.12376 163.9
[M+Na-2H]- 314.10571 160.0
[M]+ 293.13049 156.5
[M]- 293.13159 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