CID 68091161

1160556-63-7

Structural Information

Molecular Formula
C16H19BrN2
SMILES
CN(C)C1=C(C(=CC=C1)N(C)C)C2=CC=CC=C2Br
InChI
InChI=1S/C16H19BrN2/c1-18(2)14-10-7-11-15(19(3)4)16(14)12-8-5-6-9-13(12)17/h5-11H,1-4H3
InChIKey
XLVOBPSJQPPHPA-UHFFFAOYSA-N
Compound name
2-(2-bromophenyl)-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

318.07315 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.08043 167.6
[M+Na]+ 341.06237 177.3
[M-H]- 317.06587 179.2
[M+NH4]+ 336.10697 186.5
[M+K]+ 357.03631 166.8
[M+H-H2O]+ 301.07041 164.9
[M+HCOO]- 363.07135 191.3
[M+CH3COO]- 377.08700 216.2
[M+Na-2H]- 339.04782 172.2
[M]+ 318.07260 187.9
[M]- 318.07370 187.9
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

patents stripe