CID 9577613

1-(2,6-dichlorobenzylidenamino)-3,3-dimethylguanidine hydrochloride

Structural Information

Molecular Formula
C10H12Cl2N4
SMILES
CN(C)/C(=N/N=C/C1=C(C=CC=C1Cl)Cl)/N
InChI
InChI=1S/C10H12Cl2N4/c1-16(2)10(13)15-14-6-7-8(11)4-3-5-9(7)12/h3-6H,1-2H3,(H2,13,15)/b14-6+
InChIKey
WJKKONQWFUQNSO-MKMNVTDBSA-N
Compound name
2-[(E)-(2,6-dichlorophenyl)methylideneamino]-1,1-dimethylguanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

258.0439 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.05118 160.5
[M+Na]+ 281.03312 168.6
[M-H]- 257.03662 167.2
[M+NH4]+ 276.07772 179.5
[M+K]+ 297.00706 164.8
[M+H-H2O]+ 241.04116 154.6
[M+HCOO]- 303.04210 181.2
[M+CH3COO]- 317.05775 209.5
[M+Na-2H]- 279.01857 163.9
[M]+ 258.04335 163.5
[M]- 258.04445 163.5
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

No patent data available for this compound.