CID 41206

54827-17-7

Structural Information

Molecular Formula
C16H20N2
SMILES
CC1=CC(=CC(=C1N)C)C2=CC(=C(C(=C2)C)N)C
InChI
InChI=1S/C16H20N2/c1-9-5-13(6-10(2)15(9)17)14-7-11(3)16(18)12(4)8-14/h5-8H,17-18H2,1-4H3
InChIKey
UAIUNKRWKOVEES-UHFFFAOYSA-N
Compound name
4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

1721
References

124376
Patents

240.16264 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.16992 158.1
[M+Na]+ 263.15186 167.9
[M-H]- 239.15536 165.3
[M+NH4]+ 258.19646 176.0
[M+K]+ 279.12580 162.9
[M+H-H2O]+ 223.15990 151.2
[M+HCOO]- 285.16084 182.5
[M+CH3COO]- 299.17649 203.8
[M+Na-2H]- 261.13731 159.3
[M]+ 240.16209 156.9
[M]- 240.16319 156.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe