CID 12474014

2-amino-1-(2-bromophenyl)ethanol

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

214.99458 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.00186 138.2
[M+Na]+ 237.98380 140.4
[M+NH4]+ 233.02840 143.0
[M+K]+ 253.95774 141.0
[M-H]- 213.98730 138.9
[M+Na-2H]- 235.96925 141.4
[M]+ 214.99403 137.4
[M]- 214.99513 137.4
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