CID 9702

N,n,n',n'-tetramethylbenzidine

Structural Information

Molecular Formula
C16H20N2
SMILES
CN(C)C1=CC=C(C=C1)C2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C16H20N2/c1-17(2)15-9-5-13(6-10-15)14-7-11-16(12-8-14)18(3)4/h5-12H,1-4H3
InChIKey
YRNWIFYIFSBPAU-UHFFFAOYSA-N
Compound name
4-[4-(dimethylamino)phenyl]-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

1008
References

39144
Patents

240.16264 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.16992 156.9
[M+Na]+ 263.15186 163.1
[M-H]- 239.15536 166.4
[M+NH4]+ 258.19646 175.2
[M+K]+ 279.12580 161.4
[M+H-H2O]+ 223.15990 148.5
[M+HCOO]- 285.16084 183.6
[M+CH3COO]- 299.17649 207.0
[M+Na-2H]- 261.13731 161.6
[M]+ 240.16209 158.5
[M]- 240.16319 158.5
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