CID 17909064

99584-48-2

Structural Information

Molecular Formula
C3HCl2N3
SMILES
C1=C(N=NC(=N1)Cl)Cl
InChI
InChI=1S/C3HCl2N3/c4-2-1-6-3(5)8-7-2/h1H
InChIKey
DHFJTUKAWMNXNY-UHFFFAOYSA-N
Compound name
3,6-dichloro-1,2,4-triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

88
Patents

148.95476 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.96204 119.8
[M+Na]+ 171.94398 131.5
[M-H]- 147.94748 118.8
[M+NH4]+ 166.98858 138.2
[M+K]+ 187.91792 127.6
[M+H-H2O]+ 131.95202 113.3
[M+HCOO]- 193.95296 132.2
[M+CH3COO]- 207.96861 133.5
[M+Na-2H]- 169.92943 129.3
[M]+ 148.95421 121.6
[M]- 148.95531 121.6
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