CID 19644

3805-65-0

Structural Information

Molecular Formula
C14H14BrN3
SMILES
CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)Br
InChI
InChI=1S/C14H14BrN3/c1-18(2)14-9-7-13(8-10-14)17-16-12-5-3-11(15)4-6-12/h3-10H,1-2H3
InChIKey
GMAYRELXLJMMQU-UHFFFAOYSA-N
Compound name
4-[(4-bromophenyl)diazenyl]-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

303.0371 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.04438 159.9
[M+Na]+ 326.02632 169.7
[M-H]- 302.02982 172.6
[M+NH4]+ 321.07092 179.4
[M+K]+ 342.00026 159.2
[M+H-H2O]+ 286.03436 156.4
[M+HCOO]- 348.03530 187.7
[M+CH3COO]- 362.05095 214.3
[M+Na-2H]- 324.01177 168.2
[M]+ 303.03655 180.0
[M]- 303.03765 180.0
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