CID 11127564

597563-15-0

Structural Information

Molecular Formula
C9H10BrN
SMILES
C1CC1(C2=CC(=CC=C2)Br)N
InChI
InChI=1S/C9H10BrN/c10-8-3-1-2-7(6-8)9(11)4-5-9/h1-3,6H,4-5,11H2
InChIKey
BOEYJHQOBAKCJT-UHFFFAOYSA-N
Compound name
1-(3-bromophenyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

177
Patents

210.99966 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.00694 131.4
[M+Na]+ 233.98888 136.8
[M+NH4]+ 229.03348 139.3
[M+K]+ 249.96282 135.9
[M-H]- 209.99238 140.4
[M+Na-2H]- 231.97433 140.7
[M]+ 210.99911 134.8
[M]- 211.00021 134.8
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