CID 81076

2,4-dichloro-6-morpholino-1,3,5-triazine

Structural Information

Molecular Formula
C7H8Cl2N4O
SMILES
C1COCCN1C2=NC(=NC(=N2)Cl)Cl
InChI
InChI=1S/C7H8Cl2N4O/c8-5-10-6(9)12-7(11-5)13-1-3-14-4-2-13/h1-4H2
InChIKey
UQAMDAUJTXFNAD-UHFFFAOYSA-N
Compound name
4-(4,6-dichloro-1,3,5-triazin-2-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

9890
Patents

234.00752 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.01480 146.1
[M+Na]+ 256.99674 155.1
[M-H]- 233.00024 146.4
[M+NH4]+ 252.04134 157.9
[M+K]+ 272.97068 151.6
[M+H-H2O]+ 217.00478 136.4
[M+HCOO]- 279.00572 152.0
[M+CH3COO]- 293.02137 156.6
[M+Na-2H]- 254.98219 152.2
[M]+ 234.00697 145.5
[M]- 234.00807 145.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe