CID 66799

Bis(2,4-diamino-5-methylphenyl)methane

Structural Information

Molecular Formula
C15H20N4
SMILES
CC1=CC(=C(C=C1N)N)CC2=C(C=C(C(=C2)C)N)N
InChI
InChI=1S/C15H20N4/c1-8-3-10(14(18)6-12(8)16)5-11-4-9(2)13(17)7-15(11)19/h3-4,6-7H,5,16-19H2,1-2H3
InChIKey
HGVQBXSOAUVVNX-UHFFFAOYSA-N
Compound name
4-[(2,4-diamino-5-methylphenyl)methyl]-6-methylbenzene-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

18
Patents

256.1688 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.17608 163.0
[M+Na]+ 279.15802 171.6
[M-H]- 255.16152 169.2
[M+NH4]+ 274.20262 178.9
[M+K]+ 295.13196 166.4
[M+H-H2O]+ 239.16606 155.4
[M+HCOO]- 301.16700 188.4
[M+CH3COO]- 315.18265 210.5
[M+Na-2H]- 277.14347 163.2
[M]+ 256.16825 158.2
[M]- 256.16935 158.2
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.