CID 12697788

2-[(4-bromophenyl)amino]ethan-1-ol

Structural Information

Molecular Formula
C8H10BrNO
SMILES
C1=CC(=CC=C1NCCO)Br
InChI
InChI=1S/C8H10BrNO/c9-7-1-3-8(4-2-7)10-5-6-11/h1-4,10-11H,5-6H2
InChIKey
GYWMAZOWKOVMKS-UHFFFAOYSA-N
Compound name
2-(4-bromoanilino)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

214.99458 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.00186 138.9
[M+Na]+ 237.98380 141.7
[M+NH4]+ 233.02840 144.0
[M+K]+ 253.95774 141.3
[M-H]- 213.98730 139.9
[M+Na-2H]- 235.96925 142.8
[M]+ 214.99403 138.3
[M]- 214.99513 138.3
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