CID 18965220

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

Structural Information

Molecular Formula
C6H5Cl2N3
SMILES
C1CC1C2=NC(=NC(=N2)Cl)Cl
InChI
InChI=1S/C6H5Cl2N3/c7-5-9-4(3-1-2-3)10-6(8)11-5/h3H,1-2H2
InChIKey
RHYYBHZFUCSINS-UHFFFAOYSA-N
Compound name
2,4-dichloro-6-cyclopropyl-1,3,5-triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

188.98605 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.993326 138.9
[M+Na]+ 211.975268 151.3
[M-H]- 187.978774 141.3
[M+NH4]+ 207.019873 151.0
[M+K]+ 227.949208 145.6
[M+H-H2O]+ 171.983310 130.8
[M+HCOO]- 233.984251 151.1
[M+CH3COO]- 247.999901 151.0
[M+Na-2H]- 209.960716 145.3
[M]+ 188.98550142 142.6
[M]- 188.98659858 142.6
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