CID 3049420

Brn 0670668

Structural Information

Molecular Formula
C10H6Cl2N4O
SMILES
COC1=C(C(=CC(=C1)Cl)Cl)NN=C(C#N)C#N
InChI
InChI=1S/C10H6Cl2N4O/c1-17-9-3-6(11)2-8(12)10(9)16-15-7(4-13)5-14/h2-3,16H,1H3
InChIKey
HGQYVAMMTRGTGX-UHFFFAOYSA-N
Compound name
2-[(2,4-dichloro-6-methoxyphenyl)hydrazinylidene]propanedinitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.99185 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.99913 165.9
[M+Na]+ 290.98107 176.8
[M-H]- 266.98457 169.8
[M+NH4]+ 286.02567 177.8
[M+K]+ 306.95501 172.1
[M+H-H2O]+ 250.98911 152.1
[M+HCOO]- 312.99005 174.6
[M+CH3COO]- 327.00570 227.5
[M+Na-2H]- 288.96652 166.8
[M]+ 267.99130 160.7
[M]- 267.99240 160.7
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.