CID 20879

Imidodicarbonimidic diamide, n-(2,4-dimethylphenyl)-

Structural Information

Molecular Formula
C10H15N5
SMILES
CC1=CC(=C(C=C1)N=C(N)N=C(N)N)C
InChI
InChI=1S/C10H15N5/c1-6-3-4-8(7(2)5-6)14-10(13)15-9(11)12/h3-5H,1-2H3,(H6,11,12,13,14,15)
InChIKey
NEOMBHNYODRTQG-UHFFFAOYSA-N
Compound name
1-(diaminomethylidene)-2-(2,4-dimethylphenyl)guanidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

23
Patents

205.13275 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.14003 147.6
[M+Na]+ 228.12197 153.4
[M-H]- 204.12547 153.0
[M+NH4]+ 223.16657 165.9
[M+K]+ 244.09591 152.0
[M+H-H2O]+ 188.13001 139.9
[M+HCOO]- 250.13095 176.3
[M+CH3COO]- 264.14660 203.3
[M+Na-2H]- 226.10742 150.5
[M]+ 205.13220 142.7
[M]- 205.13330 142.7
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.